SCHEMBL6596134

SCHEMBL6596134

COc1cc2c(Nc3cccc4c3OCO4)c(C#N)cnc2cc1OCCCCCl

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 17/20 0.58
EGFR P00533 3/20 0.54
ERBB2 P04626 3/20 0.54
ABL1 P00519 3/20 0.54
BCR P11274 3/20 0.54
KDR P35968 1/20 0.53
FYN P06241 2/20 0.52

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
Hydrochloric Acid SCHEMBL4496561 0.99 SRC (0.57) SRCEGFRERBB2ABL1BCR
SCHEMBL4493118 0.97 SRC (0.59) SRCEGFRERBB2ABL1BCR
SCHEMBL4497195 0.92 EGFR (0.57) SRCEGFRERBB2ABL1BCR
SCHEMBL5723525 0.92 SRC (0.62) SRCEGFRERBB2ABL1BCR
SCHEMBL4489309 0.91 EGFR (0.58) SRCEGFRERBB2ABL1BCR
SCHEMBL4498596 0.87 SRC (0.55) SRCEGFRERBB2ABL1BCR
SCHEMBL7130437 0.87 SRC (0.54) SRCEGFRERBB2ABL1BCR
SCHEMBL4489459 0.87 SRC (0.56) SRCEGFRERBB2ABL1BCR
SCHEMBL5724110 0.86 SRC (0.54) SRCEGFRERBB2ABL1BCR
SCHEMBL5723587 0.86 SRC (0.68) SRCEGFRERBB2ABL1BCR

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
EP-1409481-A1 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS Astrazeneca AB (SE) 2004-04-21 EP disclosed
WO-2003047582-A1 QUINOLINE DERIVATIVES AS ANTITUMOUR AGENTS ASTRAZENECA AB (SE) 2003-06-12 WO disclosed
WO-2003008409-A1 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2003-01-30 WO disclosed