SCHEMBL7688583

SCHEMBL7688583

Cc1ccc(-c2ccccc2C(=O)Nc2ccc3cc(C(=O)N[C@H](C)c4ccccn4)cnc3c2)cn1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 3/20 0.45
ADORA2A P29274 5/20 0.44
TRPV1 Q8NER1 1/20 0.43
MTTP P55157 2/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
OPRL1 P41146 1/20 0.41
PPARG P37231 1/20 0.40
CYP11B2 P19099 1/20 0.38
ALOX5AP P20292 1/20 0.38

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
SCHEMBL6775048 0.88 HPGDS (0.44) HPGDSADORA2ATRPV1MTTPNPC1
SCHEMBL6771208 0.87 ADORA2A (0.47) HPGDSADORA2ATRPV1NPC1RAB9A
SCHEMBL6770046 0.84 ADORA2A (0.47) HPGDSADORA2ATRPV1NPC1RAB9A
SCHEMBL6771082 0.83 HPGDS (0.42) HPGDSTRPV1MTTP
SCHEMBL6771468 0.83 OPRL1 (0.50) TRPV1NPC1RAB9AOPRL1
SCHEMBL6769613 0.83 ADORA2A (0.46) HPGDSADORA2ATRPV1NPC1RAB9A
SCHEMBL6772000 0.83 HPGDS (0.55) HPGDSADORA2ANPC1RAB9A
SCHEMBL6766033 0.83 ADORA2A (0.46) HPGDSADORA2ATRPV1
SCHEMBL6769816 0.82 TRPV1 (0.46) HPGDSADORA2ATRPV1
SCHEMBL6771609 0.78 SMO (0.47) TRPV1MTTP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6369075-B1 7[4′-trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and method of inhibiting the secretion of apolipoprotein B PFIZER, INC. 2002-04-09 US disclosed
EP-1099701-A1 7-[(4'-Trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and methods of inhibiting the secretion of apolipoprotein B Pfizer Products Inc. (US) 2001-05-16 EP disclosed