SCHEMBL9195294

SCHEMBL9195294

Cc1c(CC(=O)O)nn(Cc2nc3cc(F)cc(F)c3s2)c(=O)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 20/20 1.00

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
SCHEMBL1590287 0.84 AKR1B1 (1.00) AKR1B1
SCHEMBL9201252 0.80 AKR1B1 (1.00) AKR1B1
SCHEMBL9872753 0.80 AKR1B1 (0.87) AKR1B1
SCHEMBL9322386 0.79 AKR1B1 (1.00) AKR1B1
SCHEMBL9321335 0.77 AKR1B1 (1.00) AKR1B1
SCHEMBL8466444 0.75 AKR1B1 (0.60) AKR1B1
SCHEMBL9201275 0.75 AKR1B1 (1.00) AKR1B1
SCHEMBL10584475 0.71 AKR1B1 (0.67) AKR1B1
SCHEMBL8304641 0.70 AKR1B1 (0.62) AKR1B1
SCHEMBL9323686 0.70 AKR1B1 (0.79) AKR1B1

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-0662962-A1 SUBSTITUTED PYRIMIDINES FOR CONTROL OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1995-07-19 EP disclosed
WO-1994007867-A1 SUBSTITUTED PYRIMIDINES FOR CONTROL OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1994-04-14 WO disclosed