SCHEMBL15988264

SCHEMBL15988264

Cc1ccc2c(c1-c1ccc3c(N4CCOC[C@@H]4C)nncc3c1)ON(C)C2N

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.65
CYP3A4 P08684 7/20 0.65
KIT P10721 2/20 0.62
PDGFRB P09619 1/20 0.62
KCNH2 Q12809 1/20 0.62
MAPK11 Q15759 1/20 0.62
KDR P35968 1/20 0.53
MAPK9 P45984 1/20 0.53
MTOR P42345 7/20 0.39
ATM Q13315 1/20 0.39
ATR Q13535 1/20 0.39

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
SCHEMBL5261939 0.81 MAPK14 (0.65) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2949832 0.79 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2944350 0.78 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2945978 0.78 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2953268 0.77 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2955984 0.77 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2955992 0.77 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2951782 0.76 MAPK14 (0.84) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2953518 0.75 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2946012 0.75 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2

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-1856058-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-09-03 EP claimed