SCHEMBL9502200

SCHEMBL9502200

CS(=O)(=O)OCc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.55
CA9 Q16790 6/20 0.55
CA1 P00915 5/20 0.55
LTA4H P09960 4/20 0.47
CALM1 P0DP23 1/20 0.46
CA12 O43570 2/20 0.44
CA14 Q9ULX7 1/20 0.44
LMNA P02545 2/20 0.44
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
AR P10275 1/20 0.42
RAB9A P51151 1/20 0.42
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HTT P42858 1/20 0.41
PLA2G10 O15496 1/20 0.40
PLA2G2A P14555 1/20 0.40
IDO1 P14902 1/20 0.39

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
Benzene SCHEMBL27447210 0.92 CA2 (0.63) CA2CA9CA1CA12HPGD
SCHEMBL249386 0.92 CA2 (0.63) CA2CA9CA1CA12HPGD
Formaldehyde SCHEMBL28740532 0.88 CA2 (0.59) CA2CA9CA1CA12HPGD
Ethyne SCHEMBL28196610 0.88 CA2 (0.59) CA2CA9CA1CA12HPGD
SCHEMBL27571883 0.86 TSHR (0.60) CA2CA9CA1CA12HPGD
SCHEMBL4952656 0.85 CA2 (0.58) CA2CA9CA1CA12LMNA
SCHEMBL6286312 0.85 IDO1 (0.52) CA2CA9CA1LMNATSHR
SCHEMBL874437 0.84 AR (0.62) CA2CA9CA1CA12LMNA
SCHEMBL10476140 0.82 TBXAS1 (0.49)
SCHEMBL20761720 0.81 PGR (0.50) CA2CA9CA1LTA4HLMNA

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
EP-0186190-B1 BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-26 EP disclosed
EP-0132606-B1 BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-07 EP disclosed
US-4663339-A Acaricidal and insecticidal substituted 1-phenylalkylbenzimidazoles SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-05-05 US disclosed
US-4612323-A Insecticidal and acaricidal derivatives of 1-benzylbenzimidazole SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-09-16 US disclosed
EP-0186190-A2 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-07-02 EP disclosed
EP-0132606-A1 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-02-13 EP disclosed