SCHEMBL8319320

SCHEMBL8319320

CC(C)=NN1C(=O)CC2(C(=O)N(Cc3ccc(Br)cc3F)C(=O)c3ccc(F)cc32)C1=O

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 4/20 0.66
AKR1B10 O60218 1/20 0.66
AKR1A1 P14550 1/20 0.66

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
SCHEMBL8320547 0.91 AKR1B1 (0.64) AKR1B1AKR1B10AKR1A1
SCHEMBL9777783 0.86 AKR1B1 (0.71) AKR1B1AKR1B10AKR1A1
SCHEMBL9728656 0.85 AKR1B1 (0.70) AKR1B1AKR1B10AKR1A1
SCHEMBL8328329 0.84 AKR1B1 (0.71) AKR1B1AKR1B10AKR1A1
SCHEMBL8323375 0.82 AKR1B1 (0.62) AKR1B1AKR1B10AKR1A1
Minalrestat SCHEMBL30602643 0.79 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1
Minalrestat SCHEMBL9384195 0.79 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1
Minalrestat SCHEMBL9388567 0.79 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1
Minalrestat SCHEMBL29727574 0.79 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1
Minalrestat SCHEMBL49649 0.79 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1

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-0555327-B1 ALKYLIDENE ANALOGS OF 1'-AMINOSPIRO-[ISOQUINOLINE- 4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES USEFUL AS ALDOSE REDUCTASE INHIBITORS IN VIVO AMERICAN HOME PROD (US) 1999-01-13 EP claimed
US-5068332-A Antidiabetic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-11-26 US claimed
EP-0555327-B1 ALKYLIDENE ANALOGS OF 1'-AMINOSPIRO-[ISOQUINOLINE- 4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES USEFUL AS ALDOSE REDUCTASE INHIBITORS IN VIVO AMERICAN HOME PROD (US) 1999-01-13 EP disclosed
EP-0555327-A1 ALKYLIDENE ANALOGS OF 1'-AMINOSPIRO-[ISOQUINOLINE- 4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES USEFUL AS ALDOSE REDUCTASE INHIBITORS IN VIVO AMERICAN HOME PRODUCTS CORPORATION (US) 1993-08-18 EP disclosed
WO-1992006974-A1 ALKYLIDENE ANALOGS OF 1'-AMINOSPIRO[ISOQUINOLINE-4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES USEFUL AS ALDOSE REDUCTASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-30 WO disclosed
US-5068332-A Antidiabetic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-11-26 US disclosed