SCHEMBL7739865

SCHEMBL7739865

O=c1[nH]c2cc(C(F)(F)F)c(-n3cccc3)cc2cc1P(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 4/20 0.61
GRIA2 P42262 4/20 0.61
GRIA3 P42263 4/20 0.61
GRIA4 P48058 4/20 0.61
GRIK1 P39086 1/20 0.49
GRIK2 Q13002 1/20 0.49
GRIK3 Q13003 1/20 0.49
GRIK4 Q16099 1/20 0.49
GRIK5 Q16478 1/20 0.49

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
SCHEMBL7740361 0.82 GRIA1 (0.54) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7740364 0.81 GRIA1 (0.48) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7740662 0.81 GRIA1 (0.46) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8684653 0.79 GRIA1 (0.63) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8609904 0.77 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7741405 0.76 NTRK1 (0.38) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6927437 0.74 CA1 (0.41) GRIA1GRIA2GRIA3GRIA4
SCHEMBL28748171 0.73 GRIA1 (0.32) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8828097 0.72 DAO (0.37) GRIK1
SCHEMBL7652393 0.71 TAS2R14 (0.34) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420386-B1 SPINAL TRAUMATISM, EPILEPSY, CHRONIC NEURODEGENERATIVE DISEASES SUCH AS ALZHEIMER'S DISEASE, SCHIZOPHRENIA, LATERAL AMYOTROPHIC SCLEROSIS OR HUNTINGTON'S CHOREA. LES LABORATORIES SERVIER (FR) 2002-07-16 US disclosed