SCHEMBL30459799

SCHEMBL30459799

COc1ccc2c(cnn2-c2ccnc(Nc3cc(N)c(N(C)CCN(C)C)cc3OC)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.46
EGFR P00533 18/20 0.44

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
SCHEMBL17683146 1.00 KDR (0.46) KDREGFR
SCHEMBL17683367 0.94 KDR (0.44) KDREGFR
SCHEMBL30459747 0.90 EGFR (0.50) KDREGFR
SCHEMBL17683257 0.90 EGFR (0.50) KDREGFR
SCHEMBL17683117 0.89 KDR (0.43) KDREGFR
SCHEMBL17683357 0.89 EGFR (0.47) KDREGFR
SCHEMBL17683143 0.87 EGFR (0.53) KDREGFR
SCHEMBL29464106 0.87 ROCK1 (0.55) EGFR
SCHEMBL17683361 0.85 EGFR (0.47) KDREGFR
SCHEMBL20869971 0.84 EGFR (0.49) EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117402143-A EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2024-01-16 CN disclosed
CN-117069700-A EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-11-17 CN disclosed
CN-111187221-B EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-09-26 CN disclosed
CN-111171000-B EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-09-01 CN disclosed
CN-111170999-B EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-06-30 CN disclosed