SCHEMBL10699863

SCHEMBL10699863

COc1ccc(OC)c2[nH]c([S+]([O-])Cc3cc(C)ccc3N(C)C)nc12

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.33
HCRTR1 O43613 2/20 0.33
HCRTR2 O43614 2/20 0.33
ALOX5 P09917 1/20 0.30
EPHX2 P34913 1/20 0.30
ACHE P22303 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
SCHEMBL3692343 0.86 NQO2 (0.35)
SCHEMBL10701972 0.81 ALOX5 (0.37) HCRTR1HCRTR2ALOX5EPHX2
SCHEMBL9576670 0.77 NQO2 (0.34)
SCHEMBL10700537 0.76 PTGS2 (0.39) CRHR1
SCHEMBL10700191 0.76 IGF1R (0.32)
SCHEMBL6481794 0.76 ATP4A (0.45) ACHE
SCHEMBL6481789 0.76 ATP4A (0.36) CRHR1
SCHEMBL9398067 0.73 ATP4A (0.42)
SCHEMBL10701999 0.73 OGT (0.34)
SCHEMBL10699725 0.73 ATP4A (0.33) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0251536-A1 Benzimidazoles, their production, formulation and use as gastric acid secretion inhibitors FISONS plc (GB) 1988-01-07 EP claimed
EP-0251536-A1 Benzimidazoles, their production, formulation and use as gastric acid secretion inhibitors FISONS plc (GB) 1988-01-07 EP disclosed