SCHEMBL20003689

SCHEMBL20003689

Cc1ccc(NC(=O)C2(C(=O)Nc3ccc(Oc4ccnc5ncc(C)nc45)c(P)c3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 16/20 0.51
AXL P30530 6/20 0.43
KDR P35968 6/20 0.43
FLT3 P36888 3/20 0.43
RET P07949 2/20 0.43
KIT P10721 2/20 0.43
PDGFRA P16234 1/20 0.43
MERTK Q12866 5/20 0.43
AURKB Q96GD4 2/20 0.41
AURKA O14965 1/20 0.40
RIPK2 O43353 1/20 0.40
ABCB11 O95342 1/20 0.40
ABL1 P00519 1/20 0.40
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40
NTRK1 P04629 1/20 0.40
LCK P06239 1/20 0.40
PGR P06401 1/20 0.40
LYN P07948 1/20 0.40
CHRM2 P08172 1/20 0.40

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
SCHEMBL20003673 0.93 MET (0.51) METAXLKDRFLT3RET
SCHEMBL20003927 0.89 MET (0.65) METAXLKDRFLT3RET
SCHEMBL20003694 0.82 MET (0.65) METAXLKDRFLT3RET
SCHEMBL20003898 0.77 MET (0.56) METAXLKDRFLT3RET
SCHEMBL24444688 0.76 MET (0.67) METAXLKDRFLT3RET
SCHEMBL20003747 0.75 MET (0.55) METAXLKDRFLT3RET
SCHEMBL20003733 0.74 MET (0.54) METAXLKDRFLT3RET
SCHEMBL18256821 0.74 MET (0.67) METAXLKDRFLT3RET
SCHEMBL20003920 0.73 MET (0.51) METAXLKDRFLT3RET
SCHEMBL20003635 0.73 MET (0.59) METAXLKDRFLT3RET

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-3299369-A1 PYRIDO-AZAHETERECYDIC COMPOUND AND PREPARATION METHOD AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2018-03-28 EP disclosed