SCHEMBL941077

SCHEMBL941077

O=C(O)c1cccc(-c2ncon2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.53
KEAP1 Q14145 1/20 0.53
KAT6A Q92794 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
DDT P30046 1/20 0.50
MAOA P21397 1/20 0.48
BLVRB P30043 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
CD74 P04233 1/20 0.46
MIF P14174 1/20 0.46
VCP P55072 1/20 0.45
NR1H4 Q96RI1 1/20 0.45

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
SCHEMBL19982693 0.83 KAT6A (0.48) KMOKEAP1KAT6AL3MBTL1NPC1
SCHEMBL29045125 0.81 NPC1 (0.52) KAT6ANPC1RAB9AALDH1A1
SCHEMBL15515155 0.79 TP53 (0.46) NPC1RAB9AKDM4EALDH1A1RXRA
SCHEMBL17984217 0.79 GP6 (0.44) KMOKAT6AL3MBTL1NPC1RAB9A
SCHEMBL940696 0.77 KMO (0.62) KMOKEAP1KAT6AL3MBTL1NPC1
SCHEMBL30516097 0.77 MKNK1 (0.47) KMOKDM4EALDH1A1POLB
SCHEMBL28069322 0.76 KMO (0.67) KMOKEAP1L3MBTL1NPC1RAB9A
SCHEMBL31734205 0.76 KMO (0.67) KMOKEAP1L3MBTL1NPC1RAB9A
SCHEMBL14027290 0.76 MGLL (0.58) NPC1RAB9AKDM4EALDH1A1POLB
SCHEMBL30207 0.76 PPARA (0.46) KMOKAT6AL3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4101846-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2023-08-02 EP disclosed
CN-116514790-A Tri-aromatic heterocyclic piperazine small molecular organic compound targeting STAT3 and application thereof 华东师范大学 2023-08-01 CN disclosed
EP-4101846-A1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC Therapeutics, Inc. (US) 2022-12-14 EP disclosed
CN-114920667-A Electrochemical preparation method of astraglucol 湖南大学 2022-08-19 CN disclosed
EP-3889142-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2022-06-15 EP disclosed
US-20220071967-A1 METHOD OF TREATMENT OF SHWACHMAN-DIAMOND SYNDROME CIPOLLI MARLO (IT) 2022-03-10 US disclosed
US-11207300-B2 Method of treatment of Shwachman-diamond syndrome Cipolli, Marco 2021-12-28 US disclosed
EP-3889142-A1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC Therapeutics, Inc. (US) 2021-10-06 EP disclosed
EP-3632902-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUND AND ITS USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2021-07-14 EP disclosed
EP-3549936-B1 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUND AND ITS USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE PTC THERAPEUTICS INC (US) 2021-06-02 EP disclosed
US-8008290-B2 Compounds AMURA THERAPEUTICS LIMITED (GB) 2011-08-30 US disclosed
US-7960562-B2 Propane-1,3-dione derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2011-06-14 US disclosed
EP-2297162-A1 COMPOUNDS Amura Therapeutics Limited (GB) 2011-03-23 EP disclosed
EP-2283022-A1 FURO Ý3, 2-B¨PYRR0L-3-0NES AS CATHEPSIN S INHIBITORS Amura Therapeutics Limited (GB) 2011-02-16 EP disclosed
US-20110009385-A1 COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2011-01-13 US disclosed
US-20110009386-A1 FURO[3, 2-B] PYRR0L-3-0NES AS CATHESPIN S INHIBITORS AMURA THERAPEUTICS LIMITED (GB) 2011-01-13 US disclosed
WO-2009112826-A1 FURO [3, 2-B] PYRR0L-3-0NES AS CATHEPSIN S INHIBITORS AMURA THERAPEUTICS LIMITED (GB) 2009-09-17 WO disclosed
WO-2009112839-A1 COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2009-09-17 WO disclosed
US-20090181964-A1 Propane-1,3-Dione Derivative or Salt Thereof ASTELLAS PHARMA INC. 2009-07-16 US disclosed
EP-1864976-A1 PROPANE-1,3-DION DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2007-12-12 EP 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 (5 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-20220071967-A1 METHOD OF TREATMENT OF SHWACHMAN-DIAMOND SYNDROME DKC1, SAMHD1, RRM2B KMO 3367/4885KEAP1 1025/4885KAT6A 2514/4885
US-11207300-B2 Method of treatment of Shwachman-diamond syndrome DKC1, SAMHD1, RRM2B KMO 3367/4885KEAP1 1025/4885KAT6A 2514/4885
US-20090181964-A1 Propane-1,3-Dione Derivative or Salt Thereof GNRHR, KISS1R, FSHR KMO 907/4885KEAP1 2431/4885KAT6A 3899/4885
US-20110009385-A1 COMPOUNDS CTSK, CTSS, MMP9 KMO 2550/4885KEAP1 1675/4885KAT6A 659/4885
US-20110009386-A1 FURO[3, 2-B] PYRR0L-3-0NES AS CATHESPIN S INHIBITORS CTSS, CTSL, CTSK KMO 495/4885KEAP1 3543/4885KAT6A 1831/4885

“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.