SCHEMBL8304641

SCHEMBL8304641

O=C(O)Cc1cc2ccccc2n(Cc2nc3cc(F)cc(F)c3s2)c1=O

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 18/20 0.62
PTGDR2 Q9Y5Y4 1/20 0.42

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
SCHEMBL8304753 0.89 AKR1B1 (0.51) AKR1B1PTGDR2
SCHEMBL8304577 0.86 AKR1B1 (0.49) AKR1B1
SCHEMBL8303649 0.85 AKR1B1 (0.61) AKR1B1PTGDR2
SCHEMBL8307547 0.84 AKR1B1 (0.53) AKR1B1
SCHEMBL8305041 0.82 AKR1B1 (0.62) AKR1B1
SCHEMBL8307027 0.81 AKR1B1 (0.60) AKR1B1
SCHEMBL8306610 0.80 AKR1B1 (0.47) AKR1B1
SCHEMBL8307232 0.78 AKR1B1 (0.60) AKR1B1PTGDR2
SCHEMBL8307514 0.78 AKR1B1 (0.59) AKR1B1
SCHEMBL8307226 0.78 AKR1A1 (0.54) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633261-B1 QUINOLINE-3-ACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF YOSHITOMI PHARMACEUTICAL (JP) 1999-04-21 EP disclosed
US-5543420-A ALDOSE REDUCTASE INHIBITORS; ANTIDIABETIC AGENTS; PREVENTION OF ACCUMULATION OF SORBITOL AND GALACTITOL IN MAMMALIAN TISSUE THE GREEN CROSS CORPORATION (JP) 1996-08-06 US disclosed
EP-0633261-A1 QUINOLINE-3-ACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF THE GREEN CROSS CORPORATION (JP) 1995-01-11 EP disclosed