SCHEMBL28524167

SCHEMBL28524167

COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCC1CC(O)C1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.65
RET P07949 3/20 0.65
PDGFRB P09619 2/20 0.65
PLK4 O00444 1/20 0.65
GAK O14976 1/20 0.65
EPHB6 O15197 1/20 0.65
RIPK2 O43353 1/20 0.65
ERN1 O75460 1/20 0.65
STK10 O94804 1/20 0.65
MAP4K4 O95819 1/20 0.65
CHEK2 O96017 1/20 0.65
ABL1 P00519 1/20 0.65
EGFR P00533 1/20 0.65
ERBB2 P04626 1/20 0.65
LCK P06239 1/20 0.65
FYN P06241 1/20 0.65
CSF1R P07333 1/20 0.65
YES1 P07947 1/20 0.65
LYN P07948 1/20 0.65
MET P08581 1/20 0.65

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
SCHEMBL28571059 0.91 KDR (0.65) KDRRETPDGFRBPLK4GAK
SCHEMBL28569149 0.91 KDR (0.65) KDRRETPDGFRBPLK4GAK
SCHEMBL28526982 0.91 KDR (0.65) KDRRETPDGFRBPLK4GAK
SCHEMBL29902467 0.91 KDR (0.62) KDRRETPDGFRBPLK4GAK
SCHEMBL28523384 0.91 KDR (0.62) KDRRETPDGFRBPLK4GAK
Hydrochloric Acid SCHEMBL29902469 0.91 KDR (0.64) KDRRETPDGFRBPLK4GAK
Hydrochloric Acid SCHEMBL28582508 0.91 KDR (0.64) KDRRETPDGFRBPLK4GAK
Hydrochloric Acid SCHEMBL28573097 0.91 KDR (0.64) KDRRETPDGFRBPLK4GAK
Hydrochloric Acid SCHEMBL28573095 0.91 KDR (0.64) KDRRETPDGFRBPLK4GAK
SCHEMBL28521365 0.90 KDR (0.61) KDRRETPDGFRBPLK4GAK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112912373-B Angiogenesis inhibitor, preparation method and application thereof 北京康辰药业股份有限公司 2022-08-23 CN claimed
CN-112912373-A Angiogenesis inhibitor, preparation method and application thereof 北京康辰药业股份有限公司 2021-06-04 CN claimed
CN-112358469-A Angiogenesis inhibitor, preparation method and application thereof 北京康辰药业股份有限公司 2021-02-12 CN claimed
CN-112912373-B Angiogenesis inhibitor, preparation method and application thereof 北京康辰药业股份有限公司 2022-08-23 CN disclosed
CN-112912373-A Angiogenesis inhibitor, preparation method and application thereof 北京康辰药业股份有限公司 2021-06-04 CN disclosed
CN-112358469-A Angiogenesis inhibitor, preparation method and application thereof 北京康辰药业股份有限公司 2021-02-12 CN disclosed