SCHEMBL21884841

SCHEMBL21884841

COc1cc2nccc(Oc3ccc4[nH]c(C)cc4c3F)c2cc1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.66
PDGFRB P09619 3/20 0.66
SRC P12931 3/20 0.47
TGFBR1 P36897 3/20 0.47
RET P07949 2/20 0.47
MET P08581 2/20 0.47
PDGFRA P16234 2/20 0.47
PLK4 O00444 1/20 0.47
GAK O14976 1/20 0.47
EPHB6 O15197 1/20 0.47
RIPK2 O43353 1/20 0.47
ERN1 O75460 1/20 0.47
STK10 O94804 1/20 0.47
MAP4K4 O95819 1/20 0.47
CHEK2 O96017 1/20 0.47
ABL1 P00519 1/20 0.47
EGFR P00533 1/20 0.47
ERBB2 P04626 1/20 0.47
LCK P06239 1/20 0.47
FYN P06241 1/20 0.47

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
SCHEMBL30365113 1.00 KDR (0.66) KDRPDGFRBSRCTGFBR1RET
SCHEMBL1549357 0.96 KDR (0.66) KDRPDGFRBSRCTGFBR1RET
SCHEMBL29402410 0.96 KDR (0.66) KDRPDGFRBSRCTGFBR1RET
SCHEMBL22328212 0.91 KDR (0.60) KDRPDGFRBSRCTGFBR1RET
SCHEMBL18265416 0.91 KDR (0.77) KDRPDGFRBSRCTGFBR1RET
SCHEMBL21806043 0.90 KDR (0.59) KDRPDGFRBSRCTGFBR1RET
SCHEMBL21884884 0.85 KDR (0.75) KDRPDGFRBSRCTGFBR1RET
SCHEMBL295771 0.85 KDR (0.63) KDRPDGFRBSRCTGFBR1RET
SCHEMBL30364939 0.85 KDR (0.63) KDRPDGFRBSRCTGFBR1RET
SCHEMBL4664119 0.85 KDR (0.66) KDRPDGFRBSRCTGFBR1RET

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112996784-B Indole derivatives and their use in medicine 北京越之康泰生物医药科技有限公司 2023-05-30 CN disclosed
CN-112996784-A Indole derivatives and their use in medicine 北京越之康泰生物医药科技有限公司 2021-06-18 CN disclosed
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