SCHEMBL8056928

SCHEMBL8056928

CC1CCN(C(=O)Nc2ccc3ccccc3c2)CC(=O)N(Cc2ccccc2)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
CXCR3 P49682 2/20 0.42
FAAH O00519 6/20 0.42
EPHX2 P34913 1/20 0.41
CACNA1G O43497 1/20 0.39
CACNA1H O95180 1/20 0.39
CACNA1I Q9P0X4 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MCHR1 Q99705 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL8060420 0.89 MAPT (0.49) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8071083 0.88 FAAH (0.56) KMT2ASMN1; SMN2ALDH1A1MAPTFAAH
SCHEMBL8072755 0.87 FAAH (0.43) SMN1; SMN2ALDH1A1MAPTFAAHCACNA1G
SCHEMBL8072793 0.86 CACNA1G (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8066478 0.82 MAPT (0.51) MEN1KMT2AMAPTFAAHLMNA
SCHEMBL8072796 0.82 MAPK1 (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8071116 0.79 MAPT (0.48) MEN1KMT2AALDH1A1MAPTFAAH
SCHEMBL8068738 0.79 FAAH (0.56) KMT2ASMN1; SMN2ALDH1A1MAPTFAAH
SCHEMBL8902949 0.77 FAAH (0.54) KMT2ASMN1; SMN2ALDH1A1MAPTFAAH
SCHEMBL8071036 0.77 FAAH (0.54) KMT2ASMN1; SMN2ALDH1A1MAPTFAAH

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
US-6057311-A TREATING EATING DISORDERS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-02 US disclosed
WO-1997032860-A1 BENZODIAZONINE DERIVATIVES BINDING TO CHOLECYSTOKININ OR GASTRIN RECEPTORS JAMES BLACK FOUNDATION LIMITED (GB) 1997-09-12 WO disclosed