SCHEMBL4543707

SCHEMBL4543707

COc1ccc(F)cc1-c1cccc(-n2cnc3cc(C(C)[AsH2])ccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 6/20 0.41
SRC P12931 2/20 0.41
BACE1 P56817 1/20 0.40
KDR P35968 1/20 0.40
CTSA P10619 3/20 0.39
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KIT P10721 2/20 0.38
FLT3 P36888 2/20 0.38
HPGD P15428 2/20 0.38

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
SCHEMBL1616804 0.90 FGFR1 (0.41) FGFR1SRCBACE1KDRCTSA
SCHEMBL1616701 0.90 FGFR1 (0.41) FGFR1SRCBACE1KDRCTSA
SCHEMBL1617239 0.90 FGFR1 (0.41) FGFR1SRCBACE1KDRCTSA
SCHEMBL1617275 0.86 NR3C1 (0.40) FGFR1SRCBACE1KDRCTSA
SCHEMBL12415806 0.85 FGFR1 (0.52) FGFR1SRCBACE1KDRGABRA1
SCHEMBL1616915 0.85 FGFR1 (0.44) FGFR1SRCCTSAMAPK1SMN1; SMN2
SCHEMBL1761747 0.83 CNR1 (0.41) FGFR1SRCKDRCTSAGABRA1
SCHEMBL1616268 0.83 FGFR1 (0.41) FGFR1SRCKDRCTSAGABRA1
SCHEMBL1761975 0.83 CNR1 (0.41) FGFR1SRCKDRCTSAGABRA1
SCHEMBL1617150 0.83 FGFR1 (0.41) FGFR1SRCKDRCTSAGABRA1

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
EP-1996556-B1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX NEUROSEARCH AS (DK) 2009-11-18 EP disclosed