SCHEMBL15078680

SCHEMBL15078680

COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCN1CC[C@H]2OCC[C@H]21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.70
KDR P35968 2/20 0.67
EPHB4 P54760 2/20 0.67
CIT O14578 1/20 0.67
GAK O14976 1/20 0.67
EPHB6 O15197 1/20 0.67
ABCC4 O15439 1/20 0.67
DAPK3 O43293 1/20 0.67
RIPK2 O43353 1/20 0.67
NR1I2 O75469 1/20 0.67
RPS6KA4 O75676 1/20 0.67
STK17B O94768 1/20 0.67
STK10 O94804 1/20 0.67
PRKD3 O94806 1/20 0.67
ABCB11 O95342 1/20 0.67
MAP4K4 O95819 1/20 0.67
CHEK2 O96017 1/20 0.67
ABL1 P00519 1/20 0.67
ERBB2 P04626 1/20 0.67
LCK P06239 1/20 0.67

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
SCHEMBL15078665 0.96 EGFR (0.71) EGFRKDREPHB4CITGAK
SCHEMBL15879068 0.96 EGFR (0.71) EGFRKDREPHB4CITGAK
SCHEMBL14971145 0.89 EGFR (0.69) EGFRKDREPHB4CITGAK
SCHEMBL15946891 0.85 EGFR (0.75) EGFRKDREPHB4CITGAK
SCHEMBL15879404 0.85 EGFR (0.70) EGFRKDREPHB4ERBB2FLT4
SCHEMBL15879405 0.85 EGFR (0.70) EGFRKDREPHB4ERBB2FLT4
SCHEMBL6994537 0.85 EGFR (0.70) EGFRKDREPHB4CITGAK
SCHEMBL15938591 0.84 EGFR (0.75) EGFRKDREPHB4CITGAK
SCHEMBL14971247 0.83 EGFR (0.81) EGFRKDREPHB4CITGAK
SCHEMBL22754700 0.83 EGFR (0.81) EGFRKDREPHB4CITGAK

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
US-9546179-B2 Heterocycle amido alkyloxy substituted quinazoline derivative and use thereof Qian, Wei (CN) 2017-01-17 US disclosed
US-9546179-B2 Heterocycle amido alkyloxy substituted quinazoline derivative and use thereof Qian, Wei (CN) 2017-01-17 US disclosed
US-20140206664-A1 Heterocycle Amido Alkyloxy Substituted Quinazoline Derivative and Use Thereof QIAN WEI (CN) 2014-07-24 US disclosed
US-20140206664-A1 Heterocycle Amido Alkyloxy Substituted Quinazoline Derivative and Use Thereof QIAN WEI (CN) 2014-07-24 US disclosed
WO-2013091507-A1 HETEROCYCLE AMIDO ALKYLOXY SUBSTITUTED QUINAZOLINE DERIVATIVE AND USE THEREOF QIAN WEI (CN) 2013-06-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140206664-A1 Heterocycle Amido Alkyloxy Substituted Quinazoline Derivative and Use Thereof EGFR, ERBB2, ERBB4 EGFR 1/4885KDR 96/4885EPHB4 1564/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.