SCHEMBL6597953

SCHEMBL6597953

O=C(Nc1ccccc1C(F)(F)F)OCc1nccn1-c1cc2cc(C(=O)O)c(=O)[nH]c2cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.36
PTGES O14684 2/20 0.36
GRIA1 P42261 1/20 0.36
GRIA2 P42262 1/20 0.36
GRIA3 P42263 1/20 0.36
GRIA4 P48058 1/20 0.36
POLB P06746 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NTRK1 P04629 1/20 0.35
TRPV1 Q8NER1 1/20 0.34

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
SCHEMBL6598356 0.83 GRIA1 (0.42) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6599634 0.82 MAPT (0.37)
SCHEMBL6597213 0.73 GRIA1 (0.42) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL6605093 0.72 GRIA1 (0.62) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6596409 0.72 GRIA1 (0.57) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6603908 0.72 GRIA1 (0.52) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6598151 0.71 FPR2 (0.39) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL6596000 0.71 GRIA1 (0.56) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL6594056 0.70 GRIA1 (0.51) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6597729 0.70 GRIA1 (0.67) GRIA1GRIA2GRIA3GRIA4

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