SCHEMBL6601672

SCHEMBL6601672

NC(=O)N(Cc1ccn(-c2cc3nc(C(=O)O)c(=O)[nH]c3cc2C(F)(F)F)c1)c1cccc(C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 9/20 0.47
GRIA2 P42262 9/20 0.47
GRIA3 P42263 9/20 0.47
GRIA4 P48058 9/20 0.47
GRIK1 P39086 4/20 0.44
GRIK2 Q13002 4/20 0.44
GRIK3 Q13003 4/20 0.44
GRIK4 Q16099 4/20 0.44
GRIK5 Q16478 4/20 0.44

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
SCHEMBL6606469 0.92 GRIA1 (0.44) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6602742 0.92 GRIA1 (0.52) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6601414 0.88 GRIA1 (0.46) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6605387 0.88 GRIA1 (0.45) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6602630 0.87 GRIA1 (0.48) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6605027 0.85 GRIA1 (0.44) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6380875 0.81 GRIA1 (0.40) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6376950 0.80 GRIA1 (0.39) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6380445 0.80 GRIA1 (0.45) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6601674 0.79 GRIA1 (0.70) GRIA1GRIA2GRIA3GRIA4GRIK1

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-1020453-B1 6,7-ASYMMETRICALLY DISUBSTITUTED QUINOXALINECARBOXYLIC ACID DERIVATIVES, ADDITION SALTS THEREOF, AND PROCESSES FOR THE PREPARATION OF BOTH KYORIN SEIYAKU KK (JP) 2004-05-19 EP disclosed
US-6348461-B1 CENTRAL NERVOUS SYSTEM ANTAGONIST WITH HETEROCYCLIC SUBSTITUENTS KYORIN PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 US disclosed
EP-1020453-A1 6,7-ASYMMETRICALLY DISUBSTITUTED QUINOXALINECARBOXYLIC ACID DERI VATIVES, ADDITION SALTS THEREOF, AND PROCESSES FOR THE PREPARATION OF BOTH KYORIN PHARMACEUTICAL CO., LTD. (JP) 2000-07-19 EP disclosed