SCHEMBL4037159

SCHEMBL4037159

Fc1ccc(Nc2ncnc3cc(OCCCN4CCN(CCN5CCOCC5)CC4)cc(OC4CCCC4)c23)cc1Cl

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.85
KDR P35968 11/20 0.69
SRC P12931 10/20 0.69
LCK P06239 2/20 0.59
YES1 P07947 1/20 0.59
FGFR1 P11362 1/20 0.59
CSK P41240 1/20 0.59
AURKB Q96GD4 1/20 0.59
BRAF P15056 2/20 0.59
CIT O14578 1/20 0.59
GAK O14976 1/20 0.59
EPHB6 O15197 1/20 0.59
ABCC4 O15439 1/20 0.59
DAPK3 O43293 1/20 0.59
RIPK2 O43353 1/20 0.59
NR1I2 O75469 1/20 0.59
RPS6KA4 O75676 1/20 0.59
STK17B O94768 1/20 0.59
STK10 O94804 1/20 0.59
PRKD3 O94806 1/20 0.59

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
SCHEMBL4041510 0.99 EGFR (0.84) EGFRKDRSRCLCKYES1
SCHEMBL4036399 0.96 EGFR (0.91) EGFRKDRSRCLCKYES1
SCHEMBL4207582 0.96 EGFR (0.79) EGFRKDRSRCLCKYES1
SCHEMBL4036758 0.95 EGFR (0.90) EGFRKDRSRCLCKYES1
SCHEMBL4033873 0.93 EGFR (0.89) EGFRKDRSRCLCKBRAF
SCHEMBL4034487 0.93 EGFR (0.89) EGFRKDRSRCLCKYES1
SCHEMBL4032117 0.93 EGFR (0.78) EGFRKDRSRCLCKYES1
SCHEMBL4032976 0.93 EGFR (0.85) EGFRKDRSRCLCKYES1
SCHEMBL4034410 0.93 EGFR (0.88) EGFRKDRSRCLCKYES1
SCHEMBL4035349 0.92 EGFR (0.85) EGFRKDRSRCLCKYES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1444211-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2009-01-21 EP disclosed
CN-1764651-A Quinazoline derivatives as antitumor agents ASTRAZENECA AB (SE) 2006-04-26 CN disclosed