SCHEMBL7299173

SCHEMBL7299173

CC(C)(C)c1ccc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.68
ALDH1A1 P00352 2/20 0.68
NPC1 O15118 2/20 0.68
GLA P06280 1/20 0.68
ATM Q13315 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
SMN1; SMN2 Q16637 2/20 0.64
LMNA P02545 2/20 0.64
MAPT P10636 2/20 0.64
HPGD P15428 2/20 0.64
KDM4E B2RXH2 1/20 0.64
NPY1R P25929 1/20 0.64
NPY2R P49146 1/20 0.64
SERPINE1 P05121 1/20 0.59
NR1H4 Q96RI1 5/20 0.59
PPARG P37231 2/20 0.59
POLB P06746 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
PPARA Q07869 1/20 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
SCHEMBL7297665 0.84 SERPINE1 (0.72) RAB9AALDH1A1NPC1GLAATM
SCHEMBL7303587 0.84 RAB9A (0.68) RAB9AALDH1A1NPC1GLAATM
SCHEMBL7292368 0.83 RAB9A (0.67) RAB9AALDH1A1NPC1GLAATM
SCHEMBL7292289 0.83 RAB9A (0.67) RAB9AALDH1A1NPC1GLAATM
SCHEMBL26074396 0.81 RAB9A (1.00) RAB9AALDH1A1NPC1GLAATM
SCHEMBL12218098 0.80 MAPT (0.69) RAB9ANPC1LMNAMAPTKDM4E
SCHEMBL7294749 0.80 RAB9A (0.62) RAB9AALDH1A1NPC1GLAATM
SCHEMBL14205642 0.80 RAB9A (0.70) RAB9AALDH1A1NPC1SMN1; SMN2LMNA
SCHEMBL7294922 0.79 NPC1 (0.71) RAB9AALDH1A1NPC1GLAATM
SCHEMBL7296261 0.78 RAB9A (0.78) RAB9AALDH1A1NPC1GLAATM

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