SCHEMBL8760259

SCHEMBL8760259

CC(NNC(=O)c1ccccc1)c1ccc([Si](C)(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 3/20 0.46
RAB9A P51151 2/20 0.46
GPR139 Q6DWJ6 1/20 0.43
PTGS2 P35354 2/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
ALDH1A1 P00352 4/20 0.42
LMNA P02545 2/20 0.42
ROCK2 O75116 1/20 0.42
RPS6KA5 O75582 1/20 0.42
MAP4K4 O95819 1/20 0.42
CDK1 P06493 1/20 0.42
CSF1R P07333 1/20 0.42
PRKACA P17612 1/20 0.42
FLT1 P17948 1/20 0.42
RPS6KB1 P23443 1/20 0.42
CDK2 P24941 1/20 0.42
MAPK1 P28482 1/20 0.42
AKT1 P31749 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
Benmoxin SCHEMBL8759658 0.86 GPR139 (0.55) SMN1; SMN2NPC1RAB9AGPR139PTGS2
Benmoxin SCHEMBL54431 0.86 GPR139 (0.55) SMN1; SMN2NPC1RAB9AGPR139PTGS2
Benmoxin SCHEMBL8760295 0.86 GPR139 (0.55) SMN1; SMN2NPC1RAB9AGPR139PTGS2
SCHEMBL2654331 0.83 NR1H4 (0.54) SMN1; SMN2NPC1RAB9AGPR139ALDH1A1
SCHEMBL8759636 0.82 SMN1; SMN2 (0.72) SMN1; SMN2NPC1RAB9AALDH1A1LMNA
SCHEMBL8759672 0.82 SMN1; SMN2 (0.72) SMN1; SMN2NPC1RAB9AALDH1A1LMNA
SCHEMBL8760655 0.79 PTGS2 (0.60) SMN1; SMN2NPC1RAB9APTGS2ALDH1A1
SCHEMBL8760263 0.79 PTGS2 (0.60) SMN1; SMN2NPC1RAB9APTGS2ALDH1A1
SCHEMBL8759664 0.77 MEN1 (0.55) SMN1; SMN2NPC1RAB9AALDH1A1LMNA
SCHEMBL8760609 0.77 MEN1 (0.55) SMN1; SMN2NPC1RAB9AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0631571-B1 PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES DU PONT (US) 1997-06-04 EP disclosed
US-5543571-A Preparation of optically active hydrazines and amines E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-08-06 US disclosed
US-5426223-A Hydrogenation of n-acyl hydrazones in presence of catalyst comprising complex pf transition metal bonded to phosphine ligands E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-06-20 US disclosed
US-5250731-A Asymmetric hydrogenation of N-acylhydrazones to N-acylhydrazines in presence of chiral phospholane complex E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-10-05 US disclosed
WO-1993019040-A1 PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-30 WO disclosed