SCHEMBL7301820

SCHEMBL7301820

Cc1cccc(C)c1NC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.61
TP53 P04637 1/20 0.61
THRB P10828 1/20 0.61
KCNK9 Q9NPC2 1/20 0.58
KCNK3 O14649 1/20 0.56
S1PR4 O95977 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC3 O15379 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
HDAC11 Q96DB2 1/20 0.54
NPC1 O15118 5/20 0.54
RAB9A P51151 5/20 0.54
ATM Q13315 2/20 0.54
ALDH1A1 P00352 1/20 0.54
GLA P06280 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 1/20 0.54
TRPV1 Q8NER1 2/20 0.53
MAPK1 P28482 2/20 0.52

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
SCHEMBL7294999 0.89 SMN1; SMN2 (0.54) SMN1; SMN2TP53THRBKCNK9KCNK3
SCHEMBL7296065 0.85 PKM (0.57) SMN1; SMN2TP53THRBKCNK9KCNK3
SCHEMBL9525322 0.85 NPC1 (0.59) TP53S1PR4NPC1RAB9AKDM4E
SCHEMBL15149513 0.85 SMN1; SMN2 (0.50) SMN1; SMN2TP53THRBKCNK9KCNK3
SCHEMBL2351309 0.85 ALDH1A1 (0.56) SMN1; SMN2TP53THRBNPC1RAB9A
SCHEMBL7295972 0.84 RAB9A (0.69) SMN1; SMN2TP53THRBKCNK9KCNK3
SCHEMBL9523014 0.84 S1PR4 (0.69) SMN1; SMN2S1PR4HDAC1HDAC6NPC1
SCHEMBL28605755 0.83 POLB (0.54) SMN1; SMN2TP53THRBKCNK9KCNK3
SCHEMBL7294803 0.83 KCNK9 (0.58) SMN1; SMN2TP53THRBKCNK9KCNK3
SCHEMBL9522743 0.82 S1PR4 (0.58) TP53S1PR4NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0358118-B1 Phenylamides - process for their preparation as well as a drug containing those compounds BOEHRINGER MANNHEIM GMBH (DE) 1994-03-16 EP disclosed
US-5135949-A Anticoagulants BOEHRINGER MANNHEIM GMBH (DE) 1992-08-04 US disclosed
EP-0358118-A1 Phenylamides - process for their preparation as well as a drug containing those compounds Roche Diagnostics GmbH (DE) 1990-03-14 EP disclosed