SCHEMBL19633787

SCHEMBL19633787

Oc1ccc2c(Oc3ccccc3)ccnc2c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 2/20 0.48
PDGFRA P16234 2/20 0.46
KIT P10721 1/20 0.46
KDR P35968 1/20 0.46
ALK Q9UM73 2/20 0.46
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KCNH2 Q12809 1/20 0.44
EGFR P00533 1/20 0.44
CAMK2A Q9UQM7 1/20 0.43
LTA4H P09960 1/20 0.43
NR1H2 P55055 1/20 0.43
BAX Q07812 1/20 0.43

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
SCHEMBL7463576 0.81 APP (0.52) FGFR2PDGFRAKDRALKALDH1A1
SCHEMBL22659349 0.81 EGFR (0.57) FGFR2PDGFRAKITKDRALK
SCHEMBL18754151 0.81 KDM4E (0.50) PDGFRAKDRALKKDM4EALDH1A1
SCHEMBL25466495 0.80 FGFR2 (0.60) FGFR2PDGFRAKITKDR
SCHEMBL1897179 0.80 ERBB2 (0.55) FGFR2KDRKDM4EALDH1A1EGFR
SCHEMBL12004509 0.79 PDGFRA (0.57) PDGFRAKDRALKKCNH2
SCHEMBL7465060 0.79 APP (0.50) FGFR2PDGFRAKDRALDH1A1HPGD
SCHEMBL7465843 0.79 MAPT (0.55) PDGFRAKDRALKALDH1A1HPGD
SCHEMBL13467427 0.79 MPO (0.47) FGFR2PDGFRAKDRALKKCNH2
SCHEMBL7461569 0.79 LMNA (0.49) KDRALDH1A1HPGDHSD17B10EGFR

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
WO-2017198196-A1 QUINOLINE DERIVATIVE HAVING ANTI-TUMOR ACTIVITY 王子厚 2017-11-23 WO disclosed