SCHEMBL5702191

SCHEMBL5702191

CCN(C(=O)O)c1ccc(C)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
GLA P06280 1/20 0.53
TSHR P16473 1/20 0.53
CNR2 P34972 3/20 0.51
CNR1 P21554 2/20 0.47
CYP3A4 P08684 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL10282142 0.83 ALDH1A1 (0.48) ALDH1A1GLATSHRCNR2CNR1
SCHEMBL5702149 0.83 ALDH1A1 (0.53) ALDH1A1GLATSHRCYP3A4MEN1
SCHEMBL380050 0.83 ALDH1A1 (0.76) ALDH1A1GLATSHRCYP3A4MEN1
SCHEMBL26274433 0.82 ALDH1A1 (0.47) ALDH1A1GLATSHRCNR2CNR1
SCHEMBL11037938 0.82 ALDH1A1 (0.52) ALDH1A1GLATSHRCNR2CYP3A4
SCHEMBL3646180 0.82 CYP3A4 (0.65) ALDH1A1GLATSHRCNR2CNR1
SCHEMBL11084579 0.82 ALDH1A1 (0.52) ALDH1A1GLATSHRCNR2CYP3A4
SCHEMBL915703 0.82 ALDH1A1 (0.52) ALDH1A1GLATSHRCYP3A4MEN1
SCHEMBL250872 0.82 ALDH1A1 (0.52) ALDH1A1GLATSHRCYP3A4MEN1
SCHEMBL1485828 0.82 ALDH1A1 (0.52) ALDH1A1GLATSHRCNR2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673337-A2 ARYLALKYLCARBAMATE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2006-06-28 EP claimed
WO-2005033066-A2 ARYLALKYLCARBAMATE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2005-04-14 WO claimed
EP-1673337-A2 ARYLALKYLCARBAMATE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2006-06-28 EP disclosed
WO-2005033066-A2 ARYLALKYLCARBAMATE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2005-04-14 WO disclosed