SCHEMBL14308643

SCHEMBL14308643

FC(F)(F)Oc1ccc(-c2cnn3ccc(Nc4ccc(N5CCCCC5)cc4)nc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FYN P06241 2/20 0.55
PIM1 P11309 13/20 0.47
GALR2 O43603 1/20 0.45
PIM2 Q9P1W9 9/20 0.45
FLT3 P36888 1/20 0.45
KCNH2 Q12809 1/20 0.44
RET P07949 1/20 0.43
SCN5A Q14524 2/20 0.42
PIK3CG P48736 1/20 0.42

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
SCHEMBL4340286 0.92 FYN (0.66) FYNPIM1PIM2FLT3KCNH2
SCHEMBL14308670 0.87 FYN (0.68) FYNPIM1GALR2RETPIK3CG
SCHEMBL4342860 0.84 FYN (0.58) FYNPIM1PIM2FLT3KCNH2
SCHEMBL14308654 0.84 FYN (0.55) FYNPIM1RETPIK3CG
SCHEMBL4330143 0.84 FYN (0.57) FYNPIM1PIM2FLT3KCNH2
SCHEMBL4330269 0.82 FYN (0.56) FYNPIM1PIM2FLT3KCNH2
SCHEMBL4558598 0.82 FYN (0.78) FYNPIM1PIM2FLT3KCNH2
SCHEMBL4338231 0.81 PIM1 (0.67) FYNPIM1PIM2FLT3KCNH2
SCHEMBL14357041 0.81 FYN (0.72) FYNPIM1GALR2RETPIK3CG
SCHEMBL14302628 0.79 FYN (0.57) FYNPIM1RETPIK3CG

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-1873157-A1 Pyrazolopyrimidines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same Bayer Schering Pharma Aktiengesellschaft (DE) 2008-01-02 EP disclosed