SCHEMBL7003330

SCHEMBL7003330

Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OCCCCN1CCN(C2COC(=O)C2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.55
ERBB2 P04626 4/20 0.55
KIT P10721 3/20 0.55
SRC P12931 3/20 0.55
ERBB3 P21860 3/20 0.55
KDR P35968 3/20 0.55
ERBB4 Q15303 3/20 0.55
CIT O14578 2/20 0.55
GAK O14976 2/20 0.55
EPHB6 O15197 2/20 0.55
RIPK2 O43353 2/20 0.55
STK17B O94768 2/20 0.55
STK10 O94804 2/20 0.55
ABL1 P00519 2/20 0.55
LCK P06239 2/20 0.55
LYN P07948 2/20 0.55
RET P07949 2/20 0.55
MET P08581 2/20 0.55
HCK P08631 2/20 0.55
FGR P09769 2/20 0.55

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
SCHEMBL3471800 0.98 EGFR (0.58) EGFRERBB2KITSRCERBB3
SCHEMBL7000606 0.96 EGFR (0.59) EGFRERBB2KITSRCERBB3
SCHEMBL7571326 0.89 EGFR (0.56) EGFRERBB2KITSRCERBB3
SCHEMBL7009642 0.89 EGFR (0.72) EGFRERBB2KITSRCERBB3
SCHEMBL5226343 0.89 EGFR (0.72) EGFRERBB2KITSRCERBB3
SCHEMBL7001064 0.87 EGFR (0.58) EGFRERBB2KITSRCERBB3
SCHEMBL7003518 0.86 EGFR (0.72) EGFRERBB2KITSRCERBB3
SCHEMBL5229340 0.85 EGFR (0.60) EGFRERBB2KITSRCERBB3
SCHEMBL7003725 0.85 EGFR (0.56) EGFRERBB2KITSRCERBB3
SCHEMBL5226023 0.84 EGFR (0.60) EGFRERBB2KITSRCERBB3

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-1315716-A1 BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE, AND METHODS FOR THE PRODUCTION THEREOF Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2003-06-04 EP disclosed
US-20020082270-A1 Aminoquinazolines which inhibit signal transduction mediated by tyrosine kinases BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-06-27 US disclosed
WO-2002018370-A1 BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-03-07 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-20020082270-A1 Aminoquinazolines which inhibit signal transduction mediated by tyrosine kinases MAP3K1, MAP3K19, MAP3K20 EGFR 165/4885ERBB2 28/4885KIT 279/4885

“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.