SCHEMBL6939635

SCHEMBL6939635

N#Cc1ccccc1SC(Cl)Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.37
POLB P06746 2/20 0.37
CYP2D6 P10635 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
NOS2 P35228 1/20 0.37
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
MAPT P10636 3/20 0.35
AR P10275 2/20 0.34
PGR P06401 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL8666148 0.84 ALDH1A1 (0.43) CYP1A2CYP3A4CYP2C9CYP2C19LMNA
SCHEMBL2657473 0.79 CYP1A2 (0.48) CYP1A2CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL8779798 0.77 TSHR (0.36) TSHRLMNAMAPTMEN1KMT2A
SCHEMBL4968573 0.76 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL30320250 0.75 CYP1A2 (0.57) CYP1A2CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL224653 0.75 CYP1A2 (0.57) CYP1A2CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL100732 0.75 CYP1A2 (0.76) CYP1A2CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL9018854 0.72 CYP1A2 (0.50) CYP1A2CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL11213795 0.71 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL11241316 0.71 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C9CYP2C19TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0742201-B1 PROCESS FOR PRODUCING AROMATIC OR HETEROAROMATIC SULFUR COMPOUNDS SUMITOMO SEIKA CHEMICALS (JP) 2003-02-05 EP disclosed
CN-1076346-C Process for preparing aromatic or heteroaromatic sulfur compounds SUMITOMO SEIKA CHEMICALS (JP) 2001-12-19 CN disclosed
US-5932731-A HYDROLYZING A HETEROAROMATIC HALOGENATED METHYL SULFIDE IN PRESENCE OF AN ACID SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1999-08-03 US disclosed
US-5741933-A HYDROLYSIS; OXIDATION SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1998-04-21 US disclosed
EP-0770599-A1 PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC SULFONYL HALIDES SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-05-02 EP disclosed
CN-1139428-A Process for producing aromatic or heteroaromatic sulfur compounds SUMITOMO SEIKA CHEMICALS (JP) 1997-01-01 CN disclosed
EP-0742201-A1 PROCESS FOR PRODUCING AROMATIC OR HETEROAROMATIC SULFUR COMPOUNDS SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1996-11-13 EP disclosed