SCHEMBL9685792

SCHEMBL9685792

Cc1nc(Cn2c(=O)sc3cc(F)c(N4C(=O)C5=C(CCCC5)C4=O)cc32)no1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 4/20 0.37
GRM4 Q14833 4/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRM1 Q13255 1/20 0.35
RIPK3 Q9Y572 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
SCHEMBL9685668 0.85 MAPT (0.38) GRM7GRM4GRIN1GRIN2BGRM1
SCHEMBL9687012 0.82 GRIN1 (0.37) GRM7GRM4GRIN1GRIN2BGRM1
SCHEMBL9870067 0.82 GRM7 (0.36) GRM7GRM4GRM1
SCHEMBL9687690 0.79 GRM7 (0.36) GRM7GRM4GRM1
SCHEMBL9686573 0.79 GRIN1 (0.42) GRIN1GRIN2BRIPK3
SCHEMBL10365372 0.78 GRM7 (0.37) GRM7GRM4GRM1
SCHEMBL9686841 0.77 GRIN1 (0.43) GRIN1GRIN2BRIPK3
SCHEMBL10365073 0.75 SHMT2 (0.41) GRM7GRM4GRM1
SCHEMBL10474023 0.75 SMN1; SMN2 (0.37) GRIN1GRIN2B
SCHEMBL9688013 0.75 GRIN1 (0.41) GRIN1GRIN2BRIPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0296416-B1 BENZO-ANELLATED CYCLIC COMPOUNDS NIHON BAYER AGROCHEM K.K. (JP) 1992-07-29 EP disclosed
US-5077401-A Herbicides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1991-12-31 US disclosed
US-4902335-A Benzo-fused cyclic compounds NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1990-02-20 US disclosed
EP-0296416-A1 Benzo-anellated cyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1988-12-28 EP disclosed