SCHEMBL7025833

SCHEMBL7025833

Fc1cc(C(F)(F)F)ccc1-c1n[c]ncc1-c1ncc[nH]1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 8/20 0.37
ALOX5AP P20292 8/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
MPL P40238 1/20 0.35
CYP11B2 P19099 6/20 0.33
CYP11B1 P15538 5/20 0.33
SCN9A Q15858 1/20 0.32
HSD11B1 P28845 1/20 0.32
FPR2 P25090 1/20 0.31

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
SCHEMBL7026082 0.85 CASP6 (0.38)
SCHEMBL4395865 0.84 TRPV1 (0.36) MRGPRX4FPR2
SCHEMBL18988980 0.83 MPL (0.44) FEN1ALOX5APMRGPRX4MPLCYP11B2
SCHEMBL29755488 0.83 MPL (0.44) FEN1ALOX5APMRGPRX4MPLCYP11B2
SCHEMBL7020750 0.81 TRPA1 (0.38)
SCHEMBL7844485 0.75 NISCH (0.41)
SCHEMBL4972450 0.72 GSK3B (0.44) HSD11B1
SCHEMBL7023008 0.72 NISCH (0.43)
SCHEMBL7024613 0.70 CSNK1A1 (0.40)
SCHEMBL27481658 0.70 MRGPRX4 (0.43) FEN1ALOX5APMRGPRX4FPR2

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-1317433-A2 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2003-06-11 EP disclosed
WO-2002020495-A2 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2002-03-14 WO disclosed
EP-1087963-A1 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 Chiron Corporation (US) 2001-04-04 EP disclosed
WO-1999065897-A1 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 1999-12-23 WO disclosed