SCHEMBL6598030

SCHEMBL6598030

O=C(NCc1ccn(-c2cc3cc(C(=O)O)c(=O)[nH]c3cc2C(F)(F)F)c1)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.81

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 20/20 0.81
GRIA2 P42262 20/20 0.81
GRIA3 P42263 20/20 0.81
GRIA4 P48058 20/20 0.81
GRIK1 P39086 12/20 0.70
GRIK2 Q13002 12/20 0.70
GRIK3 Q13003 12/20 0.70
GRIK4 Q16099 12/20 0.70
GRIK5 Q16478 12/20 0.70

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
SCHEMBL6593784 0.86 GRIA1 (0.83) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6602743 0.85 GRIA1 (0.79) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6597918 0.84 GRIA1 (0.57) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6596000 0.83 GRIA1 (0.56) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6602262 0.83 GRIA1 (0.74) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7972520 0.83 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7975997 0.82 GRIA1 (0.84) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8687225 0.81 GRIA1 (0.76) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6601420 0.79 GRIA1 (0.69) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6605210 0.79 GRIA1 (0.68) 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-1156044-B1 6-SUBSTITUTED HETEROQUINOLINECARBOXYLIC ACID DERIVATIVES AND ADDITION SALTS THEREOF AND PROCESSES FOR THE PREPARATION OF BOTH KYORIN SEIYAKU KK (JP) 2004-08-25 EP disclosed
US-6562839-B1 Effective for the therapy of disorder of cerebral nerve cells as antagonists against excitatory amino acid receptors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2003-05-13 US disclosed
EP-1156044-A1 6-SUBSTITUTED HETEROQUINOLINECARBOXYLIC ACID DERIVATIVES AND ADDITION SALTS THEREOF AND PROCESSES FOR THE PREPARATION OF BOTH KYORIN PHARMACEUTICAL CO., LTD. (JP) 2001-11-21 EP disclosed