SCHEMBL9370232

SCHEMBL9370232

FC(F)(F)c1ccc(COc2ccnc(CCl)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.50
MAOA P21397 6/20 0.50
HMOX1 P09601 1/20 0.44
AR P10275 1/20 0.43
IDO1 P14902 1/20 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
SCHEMBL9370437 0.86 MAOB (0.50) MAOBMAOAHMOX1AR
SCHEMBL1932255 0.80 ALOX5 (0.50) MAOBMAOA
Hydrochloric Acid SCHEMBL18686893 0.79 MEN1 (0.51) MAOBMAOA
SCHEMBL11426612 0.78 MAOB (0.67) MAOBHMOX1IDO1
SCHEMBL508476 0.77 MAOB (0.70) MAOBMAOAHMOX1IDO1
SCHEMBL5511955 0.77 MAOB (0.70) MAOBMAOAHMOX1IDO1
SCHEMBL5512565 0.77 MAOB (0.59) MAOBMAOA
SCHEMBL1843485 0.74 NOS3 (0.52)
SCHEMBL29442849 0.74 NOS3 (0.52)
Hydrochloric Acid SCHEMBL19584238 0.73 NOS3 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0321385-B1 Substituted thienoimidazole derivatives, process for their preparation, pharmaceutical compositions containing them and their use as gastric secretion inhibitors HOECHST AG (DE) 1994-08-17 EP disclosed
US-5114955-A Derivatives with pyridine as gastrointestinal disorders and antisecretory agents HOECHST AKETIENGESELLSCHAFT (DE) 1992-05-19 US disclosed
EP-0321385-A2 Substituted thienoimidazole derivatives, process for their preparation, pharmaceutical compositions containing them and their use as gastric secretion inhibitors HOECHST AKTIENGESELLSCHAFT (DE) 1989-06-21 EP disclosed