SCHEMBL6942669

SCHEMBL6942669

CCSCC(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
MAPK1 P28482 1/20 0.61
HIF1A Q16665 1/20 0.61
ERCC5 P28715 1/20 0.54
FEN1 P39748 1/20 0.54
MAPT P10636 3/20 0.52
KDM4E B2RXH2 2/20 0.52
HPGD P15428 2/20 0.52
GAA P10253 1/20 0.52
PKM P14618 1/20 0.52
ALOX12 P18054 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TSHR P16473 1/20 0.52
CASP1 P29466 1/20 0.52
POLB P06746 3/20 0.51
THRB P10828 1/20 0.51
RECQL P46063 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CYP3A4 P08684 3/20 0.50

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
SCHEMBL7806257 0.84 ALDH1A1 (0.62) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL29712843 0.82 ALDH1A1 (0.69) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL1144066 0.82 ALDH1A1 (0.69) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL2125979 0.79 ALDH1A1 (0.65) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL3770989 0.77 ALDH1A1 (0.57) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL30683369 0.76 ALDH1A1 (0.61) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL1922611 0.76 ALDH1A1 (0.61) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL5253915 0.76 ALDH1A1 (0.71) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL1691536 0.76 ALDH1A1 (1.00) ALDH1A1MAPK1HIF1AERCC5FEN1
SCHEMBL5253911 0.76 ALDH1A1 (0.71) ALDH1A1MAPK1HIF1AERCC5FEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927719-B1 Triazole derivative or salt thereof, preparation process thereof as well as pharmaceutical containing said compound SSP CO LTD (JP) 2003-07-23 EP disclosed
US-6204415-B1 2,2-DIFLUORO-2-ETHYLTHIOACETOPHENONE DERIVATIVES OF GIVEN FORMULA WHICH HAVE USE AS INTERMEDIATES TO ANTIMYCOTIC AGENTS SSP CO., LTD. (JP) 2001-03-20 US disclosed
US-6194592-B1 AS ANTIMYCOTIC AGENT SSP CO., LTD. (JP) 2001-02-27 US disclosed
US-6083968-A A FUNGICIDE; 1,1-DIFLUORO-1-ETHYL THIENYL OR ETHYL THIENYL OXIDES-2-(2,4-SUBSTITUTED PHENYL)-3-(1H-1,2,4-TRIA ZOL-1-YL)-2-OXY OR HYDROXY COMPOUND SSP CO., LTD. (JP) 2000-07-04 US disclosed
EP-0927719-A1 Triazole derivative or salt thereof, preparation process thereof as well as pharmaceutical containing said compound SSP Co., Ltd. (JP) 1999-07-07 EP disclosed