SCHEMBL29623562

SCHEMBL29623562

COCCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OC1CCN(C)CC1

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.83
ERBB2 P04626 1/20 0.65
FGFR1 P11362 1/20 0.62
FLT1 P17948 1/20 0.62
KDR P35968 1/20 0.62

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
SCHEMBL210910 1.00 EGFR (0.83) EGFRERBB2FGFR1FLT1KDR
SCHEMBL1446584 0.91 EGFR (0.84) EGFRERBB2FGFR1FLT1KDR
SCHEMBL29623536 0.91 EGFR (1.00) EGFRERBB2FGFR1FLT1KDR
SCHEMBL185721 0.91 EGFR (1.00) EGFRERBB2FGFR1FLT1KDR
SCHEMBL14489883 0.90 EGFR (0.72) EGFRERBB2
SCHEMBL186330 0.90 EGFR (0.67) EGFRERBB2
SCHEMBL29623474 0.90 EGFR (0.67) EGFRERBB2
SCHEMBL175372 0.89 EGFR (0.73) EGFRERBB2KDR
SCHEMBL29623683 0.89 EGFR (0.73) EGFRERBB2KDR
SCHEMBL1446487 0.89 EGFR (0.66) EGFRERBB2KDR

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-110840847-B Pharmaceutical compositions for the treatment of cystic fibrosis transmembrane conductance regulator mediated diseases 沃泰克斯药物股份有限公司 2022-07-29 CN disclosed
CN-110713489-B Heteroaryl SYK inhibitors 勃林格殷格翰国际有限公司 2022-05-31 CN disclosed
CN-110183440-B Heteroaryl SYK inhibitors 勃林格殷格翰国际有限公司 2022-04-22 CN disclosed