SCHEMBL6542887

SCHEMBL6542887

CCC[C@H](N)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.43
SLC6A4 P31645 3/20 0.41
CHRNA7 P36544 1/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ALOX5 P09917 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
MAOA P21397 2/20 0.36
ACHE P22303 2/20 0.36
MAOB P27338 1/20 0.36
CA7 P43166 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ROCK1 Q13464 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
ESR2 Q92731 1/20 0.36
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL12056799 1.00 SLC2A1 (0.43) SLC2A1SLC6A4CHRNA7CA12CA2
SCHEMBL29172465 1.00 SLC2A1 (0.43) SLC2A1SLC6A4CHRNA7CA12CA2
SCHEMBL23222166 0.91 SLC2A1 (0.48) SLC2A1SLC6A4CA2ROCK1KDM4E
SCHEMBL28713370 0.84 CYP1A2 (0.44) SLC2A1SLC6A4CHRNA7ALOX5MAOA
SCHEMBL7134261 0.82 SLC2A1 (0.43) SLC2A1SLC6A4CA12CA2CA9
SCHEMBL19559157 0.82 SLC2A1 (0.43) SLC2A1SLC6A4ROCK1CYP1A2CYP2D6
SCHEMBL3865060 0.81 SLC6A4 (0.59) SLC6A4CHRNA7ALOX5MAOAACHE
SCHEMBL8286101 0.81 SLC6A4 (0.59) SLC6A4CHRNA7ALOX5MAOAACHE
SCHEMBL3863807 0.81 SLC6A4 (0.59) SLC6A4CHRNA7ALOX5MAOAACHE
SCHEMBL16276165 0.80 ACHE (0.40) SLC2A1SLC6A4CHRNA7ALOX5MAOA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117185976-B Synthesis method of compound L635 深圳市灵兰生物医药科技有限公司 2024-12-31 CN disclosed
CN-117185976-A Synthesis method of compound L635 深圳市灵兰生物医药科技有限公司 2023-12-08 CN disclosed
US-6806282-B2 HAVE AN ANTAGONISTIC ACTIVITY WITH RESPECT TO CORTICOTROPIN RELEASING FACTOR SANOFI-SYNTHELABO (FR) 2004-10-19 US disclosed
EP-1242389-B1 NOVEL BRANCHED SUBSTITUTED AMINO DERIVATIVES OF 3-AMINO-1-PHENYL-1H[1,2,4]TRIAZOL, METHODS FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI SYNTHELABO (FR) 2004-04-21 EP disclosed
US-20030162771-A1 Novel branched substituted amino derivatives of 3-amino-1-phenyl-1h-[1,2,4] triazol, methods for producing them and pharmaceutical compositions containing them SANOFI (FR) 2003-08-28 US disclosed
EP-1242389-A2 NOVEL BRANCHED SUBSTITUTED AMINO DERIVATIVES OF 3-AMINO-1-PHENYL-1H[1,2,4]TRIAZOL, METHODS FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2002-09-25 EP disclosed
WO-2001044207-A2 NOVEL BRANCHED SUBSTITUTED AMINO DERIVATIVES OF 3-AMINO-1-PHENYL-1H[1,2,4]TRIAZOL, METHODS FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2001-06-21 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-20030162771-A1 Novel branched substituted amino derivatives of 3-amino-1-phenyl-1h-[1,2,4] triazol, methods for producing them and pharmaceutical compositions containing them CRHR1, ADRA2C, NPY1R SLC2A1 1646/4885SLC6A4 336/4885CHRNA7 126/4885

“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.