SCHEMBL5552907

SCHEMBL5552907

CC(Cl)(C(=O)S)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.50
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP2C19 P33261 1/20 0.45
HIF1A Q16665 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 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
SCHEMBL16753453 0.82 CYP1A2 (0.60) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL305060 0.82 CYP1A2 (0.60) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL29613223 0.82 CYP1A2 (0.60) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL11715049 0.82 CYP1A2 (0.54) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL7255208 0.80 CYP1A2 (0.52) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL8818467 0.79 CYP1A2 (0.56) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL1817185 0.78 MAPT (0.63) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL3360358 0.77 MAPT (0.61) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL27622907 0.77 HDAC3 (0.57) CYP1A2MAPTKMT2ACYP2C19HIF1A
SCHEMBL20622475 0.77 HDAC3 (0.52) CYP1A2MAPTKMT2ACYP2C19HIF1A

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-0991683-B2 METHOD FOR BLOCK POLYMER SYNTHESIS BY CONTROLLED RADICAL POLYMERISATION RHODIA CHIMIE SA (FR) 2007-05-09 EP disclosed
EP-0991683-B1 METHOD FOR BLOCK POLYMER SYNTHESIS BY CONTROLLED RADICAL POLYMERISATION RHODIA CHIMIE SA (FR) 2002-10-09 EP disclosed
EP-0991683-A1 METHOD FOR BLOCK POLYMER SYNTHESIS BY CONTROLLED RADICAL POLYMERISATION RHODIA CHIMIE (FR) 2000-04-12 EP disclosed
WO-1998058974-A1 METHOD FOR BLOCK POLYMER SYNTHESIS BY CONTROLLED RADICAL POLYMERISATION RHODIA CHIMIE (FR) 1998-12-30 WO disclosed