SCHEMBL4773008

SCHEMBL4773008

Fc1ccccc1-c1n[c]no1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.46
RAB9A P51151 10/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
NFKB1 P19838 3/20 0.46
NFKB2 Q00653 3/20 0.46
RELA Q04206 3/20 0.46
PKM P14618 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.46
NOTUM Q6P988 2/20 0.46
GAA P10253 1/20 0.44
KDM4E B2RXH2 2/20 0.39
C1R P00736 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL5553573 0.77 RAB9A (0.52) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL1946632 0.77 NPC1 (0.52) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL5551673 0.77 NOTUM (0.50) L3MBTL1MAPK1NOTUMC1RALDH1A1
SCHEMBL4938081 0.77 EPHX2 (0.36) NPC1RAB9ASMN1; SMN2L3MBTL1KDM4E
SCHEMBL795461 0.71 NPC1 (0.44) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL6451424 0.69 NPC1 (0.64) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL1546047 0.68 NPC1 (0.48) NPC1RAB9ASMN1; SMN2NOTUMKDM4E
SCHEMBL13202083 0.67 NPC1 (0.47) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL30059833 0.67 NPC1 (0.47) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL3683732 0.65 NPC1 (0.39) NPC1RAB9ASMN1; SMN2KMT2AMEN1

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 9 patents. 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 claimed
US-7304070-B2 A2B adenosine receptor antagonists CV THERAPEUTICS, INC. (US) 2007-12-04 US claimed
US-20050101778-A1 A2B adenosine receptor antagonists GILEAD SCIENCES, INC. 2005-05-12 US claimed
CN-115141120-A Electrooxidation preparation method of astallurens 湖南大学 2022-10-04 CN disclosed
EP-2559689-B1 Preparation process for crystalline forms of 3-[5-(2-fluorophenyl)-[1,2,4]oxadiazol-3-yl]benzoic acid PTC THERAPEUTICS INC (US) 2017-11-29 EP disclosed
EP-2559689-A1 Preparation process for crystalline forms of 3-[5-(2-fluorophenyl)-[1,2,4]oxadiazol-3-yl]benzoic acid PTC Therapeutics, Inc. (US) 2013-02-20 EP disclosed
CN-102459595-A Inosine-containing oligonucleotides for the treatment of DMD PROSENSA TECHNOLOGIES BV 2012-05-16 CN disclosed
EP-2007365-A2 METHODS FOR THE PRODUCTION OF FUNCTIONAL PROTEIN FROM DNA HAVING A NONSENSE MUTATION AND THE TREATMENT OF DISORDERS ASSOCIATED THEREWITH PTC Therapeutics, Inc. (US) 2008-12-31 EP disclosed
WO-2007117438-A2 METHODS FOR THE PRODUCTION OF FUNCTIONAL PROTEIN FROM DNA HAVING A NONSENSE MUTATION AND THE TREATMENT OF DISORDERS ASSOCIATED THEREWITH PTC THERAPEUTICS, INC. (US) 2007-10-18 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 (1 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-20050101778-A1 A2B adenosine receptor antagonists ADORA2B, ADORA2A, ADORA1 NPC1 2702/4885RAB9A 1704/4885SMN1; SMN2 2102/4885

“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.