SCHEMBL21884829

SCHEMBL21884829

CCOc1cc2nccc(Oc3ccc4[nH]c(C)cc4c3)c2cc1OC

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.57
PDGFRA P16234 1/20 0.57
KDR P35968 6/20 0.51
AURKA O14965 3/20 0.49
LCK P06239 3/20 0.49
TEK Q02763 3/20 0.49
MET P08581 2/20 0.49
AURKB Q96GD4 2/20 0.49
FGFR2 P21802 2/20 0.49
EGFR P00533 1/20 0.49
ABL1 P00519 1/20 0.48
LYN P07948 1/20 0.48

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
SCHEMBL2062492 0.86 KDR (0.71) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL29902462 0.86 KDR (0.71) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL28567574 0.85 PDGFRA (0.53) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL2062996 0.85 KDR (0.56) PDGFRBPDGFRAKDRAURKALCK
Hydrochloric Acid SCHEMBL28914336 0.85 KDR (0.70) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL29902480 0.85 KDR (0.56) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL21884846 0.85 KDM4E (0.46) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL2063822 0.83 KDR (0.53) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL29902477 0.82 AXL (0.59) PDGFRBPDGFRAKDRAURKALCK
SCHEMBL3906497 0.82 KDM4E (0.61) PDGFRBPDGFRAKDRAURKALCK

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-2020057403-A1 INDOLE DERIVATIVE AND MEDICAL APPLICATION THEREOF 北京越之康泰生物医药科技有限公司 2020-03-26 WO disclosed