SCHEMBL9810982

SCHEMBL9810982

CSc1ccc2c(c1)C1(NC(=O)NC1=O)c1cc(F)ccc1-2

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AKR1A1 P14550 17/20 0.76
▸ AKR1B1 P15121 17/20 0.76
▸ ITGA4 P13612 1/20 0.45

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 SCHEMBL30924520 0.87 AKR1A1 (1.00) AKR1A1AKR1B1ITGA4
Imirestat SCHEMBL49034 0.87 AKR1A1 (1.00) AKR1A1AKR1B1ITGA4
SCHEMBL9672932 0.85 ITGA4 (0.67) AKR1A1AKR1B1ITGA4
SCHEMBL10927385 0.82 AKR1A1 (0.82) AKR1A1AKR1B1ITGA4
SCHEMBL9810984 0.81 AKR1A1 (0.88) AKR1A1AKR1B1ITGA4
SCHEMBL9751281 0.81 AKR1A1 (0.66) AKR1A1AKR1B1
Alconil SCHEMBL1201487 0.80 AKR1A1 (0.85) AKR1A1AKR1B1ITGA4
Alconil SCHEMBL30661866 0.80 AKR1A1 (0.85) AKR1A1AKR1B1ITGA4
SCHEMBL20845832 0.79 AKR1A1 (1.00) AKR1A1AKR1B1ITGA4
SCHEMBL9673837 0.79 AKR1A1 (0.82) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0092385-B1 HYDANTOIN DERIVATIVES FOR USE IN INHIBITING ALDOSE REDUCTASE ACTIVITY, COMPOSITIONS THEREFOR AND PROCESS FOR PREPARING SPIRO-FLUOREN COMPOUNDS ALCON LABORATORIES, INC. (US) 1991-06-12 — — EP disclosed
US-4540700-A Treatment of diabetic complications with certain spiro-imidazolidine-diones ALCON LABORATORIES, INC. (US) 1985-09-10 — — US disclosed
US-4438272-A COMPLICATIONS OF DIABETES ALCON LABORATORIES, INC. (US) 1984-03-20 — — US disclosed
US-4436745-A TETRACYCLIC SPIROHYDANTOINS ALCON LABORATORIES, INC. (US) 1984-03-13 — — US disclosed
WO-1983003543-A1 METHOD OF INHIBITING ALDOSE REDUCTASE ACTIVITY, COMPOSITIONS THEREFOR AND PROCESS FOR PREPARING SPIRO-FLUOROFLUOREN AND SPIRO-DIFLUOROFLUOREN COMPOUNDS ALCON LAB INC (US) 1983-10-27 — — WO disclosed
EP-0092385-A2 Hydantoin derivatives for use in inhibiting aldose reductase activity, compositions therefor and process for preparing spiro-fluoren compounds ALCON LABORATORIES, INC. (US) 1983-10-26 — — EP disclosed
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