SCHEMBL14092460

SCHEMBL14092460

CCCCOc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OC

nearest known ligand 0.92

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.92
KDR P35968 2/20 0.84
AURKA O14965 1/20 0.84
ERBB2 P04626 1/20 0.84
INSR P06213 1/20 0.84
FBP1 P09467 1/20 0.84
PDGFRB P09619 1/20 0.84
FLT4 P35916 1/20 0.84
CLK1 P49759 1/20 0.84
EPHB4 P54760 1/20 0.84
TEK Q02763 1/20 0.84
AURKB Q96GD4 1/20 0.84

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
SCHEMBL13529196 0.97 EGFR (0.98) EGFRKDRAURKAERBB2INSR
SCHEMBL30520472 0.95 EGFR (0.87) EGFRKDRAURKAERBB2INSR
SCHEMBL13524614 0.95 EGFR (0.87) EGFRKDRAURKAERBB2INSR
SCHEMBL28520911 0.94 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL14964773 0.94 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL30207668 0.94 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL31491085 0.94 EGFR (0.85) EGFRKDRAURKAERBB2INSR
SCHEMBL5911655 0.93 EGFR (0.86) EGFRKDRAURKAERBB2INSR
Hydrochloric Acid SCHEMBL5911498 0.92 EGFR (0.84) EGFRKDRAURKAERBB2INSR
SCHEMBL9445 0.92 EGFR (0.91) EGFRKDRAURKAERBB2INSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020163594-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-08-13 WO disclosed
WO-2020163598-A1 IMMUNOPHILIN-DEPENDENT INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-08-13 WO disclosed
US-9617227-B2 Process of preparing a quinazoline derivative SCINOPHARM (CHANGSHU) PHARMACEUTICALS, LTD. (CN) 2017-04-11 US disclosed
US-9546179-B2 Heterocycle amido alkyloxy substituted quinazoline derivative and use thereof Qian, Wei (CN) 2017-01-17 US disclosed
US-20160200688-A1 Process of Preparing a Quinazoline Derivative SCIANDA (CHANGSHU) PHARMACEUTICALS, LTD. (CN) 2016-07-14 US disclosed
WO-2015188318-A1 PROCESS FOR PREPARING QUINAZOLINE DERIVATIVE SCINOPHARM (CHANGSHU) PHARMACEUTICALS, LTD. (CN) 2015-12-17 WO disclosed
US-20140206664-A1 Heterocycle Amido Alkyloxy Substituted Quinazoline Derivative and Use Thereof QIAN WEI (CN) 2014-07-24 US disclosed
US-7417055-B2 Kinase inhibitory phosphonate analogs GILEAD SCIENCES, INC. (US) 2008-08-26 US 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 (2 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-20160200688-A1 Process of Preparing a Quinazoline Derivative ABL1, EGFR, KRAS EGFR 2/4885KDR 291/4885AURKA 390/4885
US-20140206664-A1 Heterocycle Amido Alkyloxy Substituted Quinazoline Derivative and Use Thereof EGFR, ERBB2, ERBB4 EGFR 1/4885KDR 96/4885AURKA 137/4885

“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.