SCHEMBL4019604

SCHEMBL4019604

NC(=O)c1cc2c(-c3ccc(Cl)cc3)n(-c3ccc(Cl)cc3)nc2n(CCC(F)(F)F)c1=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
RPA1 P27694 1/20 0.40
LMNA P02545 1/20 0.39
XBP1 P17861 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
PTGS2 P35354 5/20 0.39
PTGS1 P23219 4/20 0.39
CNR1 P21554 2/20 0.38
PPP1CA P62136 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
PLK1 P53350 1/20 0.36
MALT1 Q9UDY8 3/20 0.36
TGFBR1 P36897 1/20 0.35

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
SCHEMBL4024815 0.89 RPA1 (0.44) RPA1CNR1
SCHEMBL4191527 0.88 CNR1 (0.53) CNR1
SCHEMBL4022727 0.86 CHRNA7 (0.42) SMN1; SMN2LMNAMEN1KMT2APPP1CA
SCHEMBL4190428 0.85 CNR1 (0.42) CNR1MALT1
SCHEMBL4019475 0.78 CNR2 (0.46) CNR1
SCHEMBL4022474 0.76 CNR1 (0.51) CNR1
SCHEMBL4181240 0.76 CNR1 (0.49) CNR1
SCHEMBL4184513 0.75 CNR1 (0.49) CNR1
SCHEMBL4026409 0.73 CNR1 (0.46) CNR1MALT1
SCHEMBL4019662 0.71 CNR1 (0.44) RPA1CNR1

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
WO-2009095752-A1 FUSED PYRAZOLE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS, S.A. (US) 2009-08-06 WO claimed
WO-2009095752-A1 FUSED PYRAZOLE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS, S.A. (US) 2009-08-06 WO disclosed
WO-2009095752-A1 FUSED PYRAZOLE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS, S.A. (US) 2009-08-06 WO disclosed