SCHEMBL9810971

SCHEMBL9810971

O=C1NC(=O)C2(N1)c1cc(F)ccc1Oc1ccc(F)cc12

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 17/20 0.69
AKR1A1 P14550 14/20 0.69
AKR1B10 O60218 2/20 0.54
MAPT P10636 1/20 0.54

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 0.81 AKR1A1 (1.00) AKR1B1AKR1A1
Imirestat SCHEMBL49034 0.81 AKR1A1 (1.00) AKR1B1AKR1A1
SCHEMBL9810984 0.76 AKR1A1 (0.88) AKR1B1AKR1A1
Alconil SCHEMBL30661866 0.75 AKR1A1 (0.85) AKR1B1AKR1A1
Alconil SCHEMBL1201487 0.75 AKR1A1 (0.85) AKR1B1AKR1A1
SCHEMBL10606075 0.75 AKR1B1 (0.65) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL9673837 0.74 AKR1A1 (0.82) AKR1B1AKR1A1
SCHEMBL10927385 0.74 AKR1A1 (0.82) AKR1B1AKR1A1
SCHEMBL20845832 0.74 AKR1A1 (1.00) AKR1B1AKR1A1
SCHEMBL10928977 0.74 AKR1A1 (0.82) AKR1B1AKR1A1

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
WO-2021061763-A1 ALDOKETO REDUCTASE INHIBITORS AND USES THEREOF CASE WESTERN RESERVE UNIVERSITY (US) 2021-04-01 WO disclosed
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-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