SCHEMBL7303735

SCHEMBL7303735

C=CCOc1cc(C)ccc1NC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.47
ALDH1A1 P00352 5/20 0.46
HPGD P15428 5/20 0.46
RAB9A P51151 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 4/20 0.45
LMNA P02545 3/20 0.45
AHR P35869 1/20 0.45
KCNK3 O14649 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 4/20 0.44
DHODH Q02127 2/20 0.44
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
SERPINE1 P05121 1/20 0.44
MAP3K5 Q99683 1/20 0.43
NPY1R P25929 1/20 0.42
NPY2R P49146 1/20 0.42
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 1/20 0.42

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
SCHEMBL7295416 0.91 ALDH1A1 (0.52) NR1H4ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL7303695 0.84 NPC1 (0.54) NR1H4ALDH1A1RAB9ANPC1MAPT
SCHEMBL6029460 0.83 KDM4E (0.53) NR1H4ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL7301498 0.81 NR1H4 (0.56) NR1H4ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL7297398 0.81 SERPINE1 (0.54) NR1H4ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL7303513 0.76 NR1H4 (0.52) NR1H4RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL7302035 0.76 NR1H4 (0.67) NR1H4ALDH1A1HPGDRAB9ANPC1
SCHEMBL7292413 0.74 HSD17B2 (0.58) NR1H4ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL7291413 0.74 SMN1; SMN2 (0.76) NR1H4ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL7302094 0.74 SMN1; SMN2 (0.76) NR1H4ALDH1A1HPGDRAB9ASMN1; SMN2

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
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