SCHEMBL8307068

SCHEMBL8307068

O=C(O)Cc1cc2ccccc2n(Cc2nc3cc(Br)ccc3s2)c1=O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 20/20 0.61
AKR1B10 O60218 1/20 0.45
AKR1A1 P14550 1/20 0.45
GLO1 Q04760 1/20 0.45

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
SCHEMBL8303649 0.88 AKR1B1 (0.61) AKR1B1AKR1B10AKR1A1GLO1
SCHEMBL8304109 0.88 AKR1B1 (0.61) AKR1B1
SCHEMBL8307232 0.79 AKR1B1 (0.60) AKR1B1AKR1A1
SCHEMBL8304753 0.78 AKR1B1 (0.51) AKR1B1AKR1A1
SCHEMBL8307027 0.78 AKR1B1 (0.60) AKR1B1
SCHEMBL8305341 0.78 AKR1B1 (0.60) AKR1B1
SCHEMBL8304641 0.77 AKR1B1 (0.62) AKR1B1
SCHEMBL8304577 0.77 AKR1B1 (0.49) AKR1B1
SCHEMBL8305041 0.77 AKR1B1 (0.62) AKR1B1
SCHEMBL8306610 0.77 AKR1B1 (0.47) 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