SCHEMBL7359747

SCHEMBL7359747

O=C(O)c1ccccc1Cn1c(=O)c(=O)[nH]c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.45
GRIK1 P39086 2/20 0.45
GRIK2 Q13002 2/20 0.45
GRIK3 Q13003 2/20 0.45
GRIK4 Q16099 2/20 0.45
GRIK5 Q16478 2/20 0.45
FASN P49327 1/20 0.44
GRIA1 P42261 2/20 0.44
GRIA2 P42262 2/20 0.44
GRIA3 P42263 2/20 0.44
GRIA4 P48058 2/20 0.44
PARP1 P09874 1/20 0.42
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
PLA2G10 O15496 1/20 0.41
MGAM O43451 1/20 0.41
PLA2G2A P14555 1/20 0.41
PLA2G5 P39877 1/20 0.41

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
SCHEMBL7349744 0.92 GRIK1 (0.45) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL7354860 0.86 GRIK1 (0.47) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL7354439 0.84 CYP1A2 (0.48) MEN1POLBKMT2ANOX4
SCHEMBL7353587 0.82 PGR (0.52) PGRGRIK1GRIK2GRIK3GRIK4
SCHEMBL7352784 0.81 PGR (0.49) PGRGRIK1GRIK2GRIK3GRIK4
SCHEMBL9093246 0.79 GRIA1 (0.58) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL7357010 0.78 GRIK1 (0.47) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8609965 0.78 CYP1A2 (0.57) PGRGRIK1GRIK2GRIK3GRIK4
SCHEMBL7351187 0.76 GRIK1 (0.55) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL9556876 0.75 PGR (0.50) PGRGRIK1GRIK2GRIK3GRIK4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288065-B1 CENTRAL NERVOUS SYSTEM DISORDERS; PARKINSON*S AND ALZHEIMER*S DISEASE SCHERING AKTIENGESEELLSCHAFT (DE) 2001-09-11 US disclosed
US-6057304-A Quinoxaline-phosphonic acid derivatives SCHERING AKTIENGESELLSCHAFT (DE) 2000-05-02 US disclosed