SCHEMBL11048812

SCHEMBL11048812

O=C1NC(=O)C2(N1)C(=O)N(Cc1ccc(Br)cc1F)c1ccc(Cl)cc12

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.50
AKR1B1 P15121 6/20 0.43
AKR1A1 P14550 2/20 0.43
AKR1B10 O60218 1/20 0.41

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
SCHEMBL10957429 0.90 AKR1B1 (0.53) AKR1B1AKR1A1AKR1B10
SCHEMBL4252944 0.88 AKR1B1 (0.42) AKR1B1AKR1A1AKR1B10
SCHEMBL10956203 0.86 AKR1B1 (0.51) AKR1B1AKR1A1AKR1B10
SCHEMBL11007731 0.86 AKR1B1 (0.41) AKR1B1AKR1A1AKR1B10
SCHEMBL11047602 0.84 AKR1B1 (0.40) AKR1B1AKR1A1AKR1B10
SCHEMBL10844292 0.82 CHRM5 (0.51) AKR1B1
SCHEMBL10365052 0.81 CHRM5 (0.55) AKR1B1AKR1A1AKR1B10
SCHEMBL4255735 0.78 TP53 (0.52) PTGDR2AKR1B1AKR1A1
SCHEMBL11045654 0.77 TP53 (0.54) AKR1B1AKR1A1
SCHEMBL4254345 0.77 PTGDR2 (0.42) PTGDR2AKR1B1AKR1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028906-B1 1'-SUBSTITUTED-SPIRO(IMIDAZOLIDINE-4,3'-INDOLINE)-2,2',5-TRIONES, PROCESSES FOR THEIR MANUFACTURE AND PHARMACEUTICAL COMPOSITIONS THEREOF IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-10-03 EP claimed
EP-0028906-A1 1'-Substituted-spiro(imidazolidine-4,3'-indoline)-2,2',5-triones, processes for their manufacture and pharmaceutical compositions thereof IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-05-20 EP claimed
US-4490381-A HYPOGLYCEMIC AND ANTIDIABETIC AGENTS, ALSO ALDOSE REDUCTASE INHIBIIOTRS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-12-25 US disclosed
EP-0028906-B1 1'-SUBSTITUTED-SPIRO(IMIDAZOLIDINE-4,3'-INDOLINE)-2,2',5-TRIONES, PROCESSES FOR THEIR MANUFACTURE AND PHARMACEUTICAL COMPOSITIONS THEREOF IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-10-03 EP disclosed
US-4386100-A COMPLICATIONS OF DIABETES OR GALACTOSEMIA IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-05-31 US disclosed
EP-0066378-A1 Pharmaceutical spiro-hydantoin derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-12-08 EP disclosed
EP-0028906-A1 1'-Substituted-spiro(imidazolidine-4,3'-indoline)-2,2',5-triones, processes for their manufacture and pharmaceutical compositions thereof IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-05-20 EP disclosed