SCHEMBL9836968

SCHEMBL9836968

O=C1NC(=O)C2(CC(CCBr)Oc3ccc(F)cc32)N1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 11/20 0.62
AKR1A1 P14550 3/20 0.62
AKR1B10 O60218 2/20 0.62
MAPT P10636 1/20 0.55

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
SCHEMBL9181175 0.91 AKR1B1 (0.65) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL10571505 0.89 AKR1B1 (0.62) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL9257211 0.87 AKR1B1 (0.66) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL9255149 0.86 AKR1B1 (0.68) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL9254962 0.86 AKR1B1 (0.68) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL9184546 0.86 AKR1B1 (0.65) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL10574757 0.86 AKR1B1 (0.65) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL10576515 0.86 AKR1B1 (0.59) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL10607407 0.81 AKR1B1 (0.74) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL10575326 0.80 AKR1B1 (0.69) AKR1B1AKR1A1AKR1B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0264586-B1 HYDANTOIN DERIVATIVES FOR TREATING COMPLICATIONS OF DIABETES SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1991-04-03 EP disclosed
EP-0264586-A1 Hydantoin derivatives for treating complications of diabetes SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1988-04-27 EP disclosed