SCHEMBL5328403

SCHEMBL5328403

CC(=O)Oc1ccc(N)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.48
TSHR P16473 4/20 0.48
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
GAA P10253 2/20 0.44
RAB9A P51151 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CFD P00746 2/20 0.43
ALOX12 P18054 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
THRB P10828 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
CASP1 P29466 1/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP19A1 P11511 1/20 0.42
NR3C1 P04150 1/20 0.41
GLA P06280 1/20 0.41

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
SCHEMBL13122942 0.85 CYP3A4 (0.43) CYP3A4TSHRKDM4EALDH1A1GAA
SCHEMBL29130750 0.83 CYP3A4 (0.50) CYP3A4TSHRALDH1A1GAACA1
SCHEMBL6247630 0.82 TSHR (0.58) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL3926982 0.82 SLC6A2 (0.39) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL987450 0.81 ALDH1A1 (0.47) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL134715 0.81 KMT2A (0.57) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL19180998 0.81 RAB9A (0.54) CYP3A4TSHRKDM4EALDH1A1GAA
SCHEMBL14143479 0.81 ALOX15 (0.46) CYP3A4TSHRKDM4EALDH1A1GAA
SCHEMBL17072170 0.79 GAA (0.49) CYP3A4TSHRKDM4EALDH1A1GAA
SCHEMBL4520980 0.79 ACHE (0.46) TSHRKDM4EALDH1A1GAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007144729-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF CLOPIDOGREL ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2007-12-21 WO disclosed