SCHEMBL60783

SCHEMBL60783

O=C(O)c1cccc(-c2noc(-c3cccnc3)n2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.67
TP53 P04637 6/20 0.67
KMO O15229 1/20 0.67
NPC1 O15118 7/20 0.66
RAB9A P51151 7/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
CHRNB2 P17787 4/20 0.66
CHRNA5 P30532 4/20 0.66
CHRNA4 P43681 4/20 0.66
MAPT P10636 3/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
MAOA P21397 1/20 0.60
BLVRB P30043 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
ALDH1A1 P00352 3/20 0.59
KDM4E B2RXH2 1/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1422372 0.95 KMO (0.67) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL61063 0.86 NPC1 (0.69) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL12171589 0.86 SMN1; SMN2 (0.75) SMN1; SMN2TP53NPC1RAB9ACHRNB2
SCHEMBL60427 0.86 NPC1 (0.76) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL4456727 0.84 CA9 (0.55) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL4456725 0.84 CA9 (0.55) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL59247 0.83 RAB9A (0.72) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL17336565 0.83 NPC1 (0.72) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL12171569 0.83 NPC1 (0.76) SMN1; SMN2TP53KMONPC1RAB9A
SCHEMBL1422479 0.83 CHRNB2 (0.64) SMN1; SMN2TP53NPC1RAB9ACHRNB2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 434 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4851933-B2 2012-01-11 JP claimed
EP-1689737-B1 BETA-LACTAMS FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LTD (GB) 2008-07-16 EP claimed
EP-1618098-A4 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PCT THERAPEUTICS INC (US) 2008-07-16 EP claimed
US-7304080-B2 E.g., 3-[5-(2-Chloro-pyridin-3-yl)-[1,2,4]oxadiazol-3-yl]-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders PTC THERAPEUTICS, INC. (US) 2007-12-04 US claimed
US-20060148863-A1 E.g., 3-[5-(2-Chloro-pyridin-3-yl)-[1,2,4]oxadiazol-3-yl]-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders PTC THERAPEUTICS, INC. 2006-07-06 US claimed
US-20060035943-A1 E.g., 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders PTC THERAPEUTICS, INC. 2006-02-16 US claimed
EP-1618098-A2 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PCT Therapeutics Inc. (US) 2006-01-25 EP claimed
WO-2004091502-A2 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS PTC THERAPEUTICS, INC. (US) 2004-10-28 WO claimed
US-20040204461-A1 translation of mRNA is allowed to continue past a nonsense mutation point, resulting in the production of a full length protein; genetic disorders; 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid PTC THERAPEUTICS, INC. 2004-10-14 US claimed
US-12043689-B2 Nickel catalysts with single metal cations for homopolymerization and copolymerization UNIVERSITY OF HOUSTON SYSTEM (US) 2024-07-23 US disclosed
US-12043688-B2 Nickel catalysts with two alkali ions for homopolymerization and copolymerization UNIVERSITY OF HOUSTON SYSTEM (US) 2024-07-23 US disclosed
EP-4374928-A2 NOVEL ALK2 INHIBITORS AND METHODS FOR INHIBITING BMP SIGNALING The Brigham And Women's Hospital Inc. (US) 2024-05-29 EP disclosed
US-20240166775-A1 NICKEL CATALYSTS WITH TWO METAL CATIONS FOR HOMOPOLYMERIZATION AND COPOLYMERIZATION UNIVERSITY OF HOUSTON SYSTEM (US) 2024-05-23 US disclosed
US-20240158439-A1 INHIBITORS OF ANTIGEN PRESENTATION BY MHC CLASS II HLA-DRB1*15:01 MOLECULES WITH ENHANCED METABOLIC STABILITY PROVID PHARMACEUTICALS INC. 2024-05-16 US disclosed
WO-2003075917-A1 COMBINATION THERAPY FOR TREATING, PREVENTING OR MANAGING PROLIFERATIVE DISORDERS AND CANCERS SIGNAL PHARMACEUTICALS, INC. (US) 2003-09-18 WO disclosed
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2003-06-26 US disclosed
US-20030073732-A1 Isothiazoloanthrones, isoxazoloanthrones, isoindolanthrones and derivatives thereof as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. 2003-04-17 US disclosed
WO-2002066450-A2 ANTHRONE DERIVATIVES AND THEIR USE AS INK INHIBITORS SIGNAL PHARMACEUTICALS, INC. (US) 2002-08-29 WO disclosed
EP-1218347-A1 PYRAZOLOANTHRONE AND DERIVATIVES THEREOF AS JNK INHIBITORS AND THEIR COMPOSITIONS SIGNAL PHARMACEUTICALS, INC. (US) 2002-07-03 EP disclosed
WO-2001012609-A1 PYRAZOLOANTHRONE AND DERIVATIVES THEREOF AS JNK INHIBITORS AND THEIR COMPOSITIONS SIGNAL PHARMACEUTICALS, INC. (US) 2001-02-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240158439-A1 INHIBITORS OF ANTIGEN PRESENTATION BY MHC CLASS II HLA-DRB1*15:01 MOLECULES WITH ENHANCED METABOLIC STABILITY HLA-DRB1, HLA-B, HLA-C SMN1; SMN2 2759/4885TP53 143/4885KMO 434/4885
US-20060035943-A1 E.g., 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders UPF1, PABPC1, PABPC4 SMN1; SMN2 19/4885TP53 2818/4885KMO 3017/4885
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof MAVS, ZC3HAV1, TIMM13 SMN1; SMN2 1189/4885TP53 3577/4885KMO 2340/4885
US-20060148863-A1 E.g., 3-[5-(2-Chloro-pyridin-3-yl)-[1,2,4]oxadiazol-3-yl]-benzoic acid; treating or preventing a disease ameliorated by modulation of premature translation termination or nonsense-mediated mRNA decay such as genetic disorders UPF1, PABPC1, PABPC4 SMN1; SMN2 13/4885TP53 3336/4885KMO 2630/4885
US-20040204461-A1 translation of mRNA is allowed to continue past a nonsense mutation point, resulting in the production of a full length protein; genetic disorders; 3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-benzoic acid UPF1, PABPC1, PABPC4 SMN1; SMN2 88/4885TP53 2360/4885KMO 2803/4885
US-20030073732-A1 Isothiazoloanthrones, isoxazoloanthrones, isoindolanthrones and derivatives thereof as JNK inhibitors and compositions and methods related thereto MAP3K7, MAPKAPK2, MAP3K2 SMN1; SMN2 4178/4885TP53 944/4885KMO 597/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.