SCHEMBL9751204

SCHEMBL9751204

Cc1ccc2c(n1)-c1ccc(F)cc1C21NC(=O)NC1=O

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AKR1A1 P14550 18/20 0.66
▸ AKR1B1 P15121 18/20 0.66
▸ ITGA4 P13612 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
Imirestat SCHEMBL49034 0.81 AKR1A1 (1.00) AKR1A1AKR1B1ITGA4
Imirestat SCHEMBL30924520 0.81 AKR1A1 (1.00) AKR1A1AKR1B1ITGA4
SCHEMBL10929554 0.79 AKR1A1 (0.64) AKR1A1AKR1B1
SCHEMBL10927385 0.79 AKR1A1 (0.82) AKR1A1AKR1B1ITGA4
SCHEMBL9672105 0.79 AKR1A1 (0.68) AKR1A1AKR1B1ITGA4
SCHEMBL9810984 0.78 AKR1A1 (0.88) AKR1A1AKR1B1ITGA4
SCHEMBL25892752 0.78 AKR1A1 (0.76) AKR1A1AKR1B1ITGA4
SCHEMBL9672199 0.75 AKR1A1 (0.71) AKR1A1AKR1B1
SCHEMBL9810982 0.75 AKR1A1 (0.76) AKR1A1AKR1B1ITGA4
SCHEMBL9672999 0.75 AKR1A1 (0.76) AKR1A1AKR1B1ITGA4

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-0306525-A4 USE OF ALDOSE REDUCTASE INHIBITORS TO ENHANCE INSULIN SENSITIVITY IN DIABETES MELLITUS — 1991-04-24 — — EP disclosed
EP-0306525-A1 USE OF ALDOSE REDUCTASE INHIBITORS TO ENHANCE INSULIN SENSITIVITY IN DIABETES MELLITUS ALCON LABORATORIES, INC. (US) 1989-03-15 — — EP disclosed
WO-1988006887-A1 USE OF ALDOSE REDUCTASE INHIBITORS TO ENHANCE INSULIN SENSITIVITY IN DIABETES MELLITUS ALCON LABORATORIES, INC. (US) 1988-09-22 — — WO disclosed
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