SCHEMBL8760609

SCHEMBL8760609

CC(NNC(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
MITF O75030 2/20 0.55
POLB P06746 2/20 0.55
GAA P10253 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
TP53 P04637 1/20 0.52
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
MAPT P10636 5/20 0.49
LMNA P02545 3/20 0.49
ALDH1A1 P00352 2/20 0.49
PHGDH O43175 1/20 0.48
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47

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
SCHEMBL8759664 1.00 MEN1 (0.55) MEN1KMT2ANPC1RAB9AMITF
SCHEMBL8760327 0.94 NPC1 (0.55) MEN1KMT2ANPC1RAB9AMITF
Benmoxin SCHEMBL8759658 0.83 GPR139 (0.55) KMT2ANPC1RAB9ASMN1; SMN2LMNA
Benmoxin SCHEMBL54431 0.83 GPR139 (0.55) KMT2ANPC1RAB9ASMN1; SMN2LMNA
Benmoxin SCHEMBL8760295 0.83 GPR139 (0.55) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL2654331 0.81 NR1H4 (0.54) NPC1RAB9APOLBSMN1; SMN2CES2
SCHEMBL4929277 0.80 MEN1 (0.77) MEN1KMT2ANPC1RAB9AMITF
SCHEMBL10763115 0.80 NPC1 (0.65) MEN1KMT2ANPC1RAB9AMITF
SCHEMBL10763104 0.80 NPC1 (0.65) MEN1KMT2ANPC1RAB9AMITF
SCHEMBL10768107 0.80 NPC1 (0.65) MEN1KMT2ANPC1RAB9AMITF

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 7 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 claimed
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
EP-0631571-A1 PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES. DU PONT (US) 1995-01-04 EP 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