SCHEMBL8779762

SCHEMBL8779762

COC(=S)c1sc(C(=O)O)cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 5/20 0.52
KDM4E B2RXH2 4/20 0.52
MAPT P10636 3/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
ALDH1A1 P00352 2/20 0.52
ALOX15 P16050 1/20 0.42
GPR35 Q9HC97 4/20 0.41
HCAR2 Q8TDS4 1/20 0.38
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
BCL2L1 Q07817 1/20 0.36
P2RY14 Q15391 1/20 0.36
GLA P06280 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35

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
SCHEMBL12272115 0.84 MAPT (0.57) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL3093344 0.79 DAO (0.65) DAOKDM4EMAPTKMT2AMEN1
Cyclopropane SCHEMBL11656570 0.74 DAO (0.59) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL22859920 0.73 DAO (0.49) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL17203200 0.71 MAPT (0.42) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL22860217 0.71 DAO (0.55) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL13994843 0.71 ALOX15 (0.44) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL577651 0.69 MAPT (0.44) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL12272939 0.69 ALDH1A1 (0.46) DAOKDM4EMAPTKMT2AMEN1
SCHEMBL4556093 0.69 ALOX15 (0.42) DAOKDM4EMAPTKMT2AMEN1

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
EP-0770599-A1 PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC SULFONYL HALIDES SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-05-02 EP disclosed