SCHEMBL6027661

SCHEMBL6027661

CCN(C(=O)O)c1cc(-c2ccc(Cl)cc2)on1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.60
CDH1 P12830 1/20 0.48
CTNNB1 P35222 1/20 0.48
TCF7L2 Q9NQB0 1/20 0.48
NOTUM Q6P988 1/20 0.48
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
THRB P10828 2/20 0.44
TP53 P04637 5/20 0.44
MAPK1 P28482 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 3/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL10870497 0.87 SMN1; SMN2 (0.57) SMN1; SMN2CDH1CTNNB1TCF7L2NOTUM
SCHEMBL10867981 0.82 SMN1; SMN2 (0.52) SMN1; SMN2CDH1CTNNB1TCF7L2NOTUM
SCHEMBL2840069 0.73 KMO (0.54) SMN1; SMN2ALDH1A1CYP1A2
SCHEMBL9550201 0.73 SMN1; SMN2 (0.50) SMN1; SMN2CDH1CTNNB1TCF7L2NOTUM
SCHEMBL6027499 0.72 CTRC (0.43) SMN1; SMN2TP53ALDH1A1MAPT
SCHEMBL892967 0.71 CDH1 (0.82) SMN1; SMN2CDH1CTNNB1TCF7L2NOTUM
SCHEMBL28762616 0.70 NOTUM (0.43) SMN1; SMN2NOTUMNPC1RAB9ATP53
SCHEMBL30316029 0.70 ALDH1A1 (0.48) SMN1; SMN2NOTUMNPC1RAB9ATP53
SCHEMBL11279312 0.70 SMN1; SMN2 (0.50) SMN1; SMN2CDH1CTNNB1TCF7L2THRB
SCHEMBL1686347 0.69 POLB (0.66) SMN1; SMN2CDH1CTNNB1TCF7L2NOTUM

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-1720829-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005090292-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2005-09-29 WO disclosed