SCHEMBL7899041

SCHEMBL7899041

Cc1ccc(-c2ccc(Cn3nc4c(=O)n(-c5cccc(C)c5C)nc-4c4c3=CCCC=4)cn2)cn1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FSCN1 Q16658 1/20 0.34
OPRM1 P35372 1/20 0.32
MET P08581 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRA5 P31644 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL3713264 0.83 GABRA1 (0.37) FSCN1GABRA1GABRA5GRIN1GRIN2B
SCHEMBL615854 0.82 L3MBTL1 (0.36) FSCN1OPRM1METGABRA1GABRA5
SCHEMBL7913305 0.76 GABRA1 (0.41) FSCN1GABRA1GABRA5
SCHEMBL615038 0.73 FGFR1 (0.38) FSCN1MET
SCHEMBL14875518 0.69 GRM2 (0.39) FSCN1
SCHEMBL7900281 0.68 FSCN1 (0.34) FSCN1
SCHEMBL3708584 0.68 F2RL3 (0.41) FSCN1GABRA1GABRA5PTGS2
SCHEMBL617119 0.68 FSCN1 (0.41) FSCN1
SCHEMBL7906411 0.66 FGFR1 (0.47) MET
SCHEMBL7901453 0.62 CHRM1 (0.42) FSCN1

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
WO-2010096338-A1 PYRAZOLO [4,3-c] CINNOLIN-3-ONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. (US) 2010-08-26 WO disclosed