SCHEMBL11289589

SCHEMBL11289589

CN1C(=O)C(=C2c3cc(Cl)cc(Cl)c3-c3c(Cl)cc(Cl)cc32)C(=O)N(C)C1=S

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.33
DNMT1 P26358 1/20 0.33
PTGS2 P35354 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 1/20 0.31
GABRQ Q9UN88 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL11280457 0.90 CHRM2 (0.35) CES1GABRPGABRDGABRA1GABRB1
SCHEMBL11285093 0.90 HTT (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL11291114 0.79 MEN1 (0.44) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL11285075 0.71 MEN1 (0.38) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL11290117 0.71 NR1H2 (0.39) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL11289615 0.71 CES1 (0.32) CES1DNMT1
SCHEMBL11285533 0.71 CASP3 (0.44) CES1PTGS2ALDH1A1MAPTHTT
SCHEMBL11281161 0.68 HKDC1 (0.43) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL11291117 0.68 CES1 (0.33) CES1DNMT1
SCHEMBL11285099 0.64 S100A4 (0.34) HTT

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
US-4349618-A 5-DIPHENYLMETHYLENE- OR 5-(FLUOREN-9-YLIDENE) THIOBARBITURIC ACID AND DERIVATIVES AS SENSITIZERS FOR N-VVINYLCARBAZOLE POLYMERS; ELECTROPHORESIS FUJI PHOTO FILM CO., LTD. (JP) 1982-09-14 US disclosed