SCHEMBL11230620

SCHEMBL11230620

CCCC(=O)c1ccc(Cl)cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
POLB P06746 2/20 0.51
GAA P10253 1/20 0.51
ALDH1A1 P00352 3/20 0.46
RECQL P46063 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALOX15 P16050 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.46
FLT1 P17948 1/20 0.45
FLT4 P35916 1/20 0.45
KDR P35968 1/20 0.45
THRB P10828 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPK1 P28482 1/20 0.44
HIF1A Q16665 1/20 0.44
HTT P42858 2/20 0.44
KDM4E B2RXH2 2/20 0.43
HSD17B3 P37058 1/20 0.43
MEN1 O00255 2/20 0.42

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
SCHEMBL14050306 0.86 POLB (0.55) TSHRPOLBGAAALDH1A1RECQL
SCHEMBL11118433 0.85 ALDH1A1 (0.50) TSHRPOLBGAAALDH1A1RECQL
SCHEMBL8688272 0.84 HTT (0.62) TSHRPOLBALDH1A1HPGDHSD17B10
SCHEMBL2125979 0.84 ALDH1A1 (0.65) TSHRPOLBALDH1A1RECQLTDP1
SCHEMBL11295591 0.83 HTT (0.45) GAAALDH1A1HPGDFLT1FLT4
SCHEMBL7965902 0.82 ALDH1A1 (0.59) TSHRPOLBGAAALDH1A1RECQL
SCHEMBL10850438 0.81 ALDH1A1 (0.67) TSHRPOLBALDH1A1RECQLTDP1
SCHEMBL5569924 0.81 MEN1 (0.51) TSHRALDH1A1RECQLTDP1ALOX15
SCHEMBL6744997 0.81 TSHR (0.51) TSHRPOLBGAAALDH1A1RECQL
SCHEMBL7447640 0.81 ABL1 (0.56) TSHRPOLBGAAALDH1A1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4344957-A Benz-acyl-benzimidazole derivatives and antiallergic compositions CIBA-GEIGY CORPORATION (US) 1982-08-17 US disclosed
EP-0000574-B1 BENZIMIDAZOLE-2 DERIVATIVES, THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF MEDICAMENTS CIBA-GEIGY AG (CH) 1982-08-04 EP disclosed
US-4323688-A ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1982-04-06 US disclosed
US-4213993-A ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1980-07-22 US disclosed
US-4141982-A ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed
EP-0000574-A1 Benzimidazole-2 derivatives, their preparation and their use for the preparation of medicaments CIBA-GEIGY AG (CH) 1979-02-07 EP disclosed