SCHEMBL245873

SCHEMBL245873

COc1cc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2cc1NC(=O)N1C[C@@H]2CCN(C)[C@@H]2C1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.69
ERBB2 P04626 8/20 0.69
ERBB4 Q15303 3/20 0.69
GAK O14976 1/20 0.62
JAK3 P52333 2/20 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
SCHEMBL253552 1.00 EGFR (0.69) EGFRERBB2ERBB4GAKJAK3
SCHEMBL254362 1.00 EGFR (0.69) EGFRERBB2ERBB4GAKJAK3
SCHEMBL243454 1.00 EGFR (0.69) EGFRERBB2ERBB4GAKJAK3
SCHEMBL254450 0.91 EGFR (0.68) EGFRERBB2ERBB4
SCHEMBL253849 0.91 EGFR (0.68) EGFRERBB2ERBB4
SCHEMBL245219 0.91 EGFR (0.68) EGFRERBB2ERBB4
SCHEMBL242560 0.91 EGFR (0.68) EGFRERBB2ERBB4
SCHEMBL15064249 0.84 ERBB2 (0.64) EGFRERBB2ERBB4JAK3
SCHEMBL254281 0.84 ERBB2 (0.64) EGFRERBB2ERBB4JAK3
SCHEMBL251657 0.84 ERBB2 (0.64) EGFRERBB2ERBB4JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130172373-A1 QUINAZOLINE COMPOUNDS HUTCHISON MEDIPHARMA LIMITED (CN) 2013-07-04 US claimed
EP-2590966-A1 QUINAZOLINE COMPOUNDS Hutchison Medipharma Limited (CN) 2013-05-15 EP claimed
WO-2012000356-A1 QUINAZOLINE COMPOUNDS HUTCHISON MEDIPHARMA LIMITED (CN) 2012-01-05 WO claimed
US-9168253-B2 Quinazoline compounds HUTCHISON MEDIPHARMA LIMITED (CN) 2015-10-27 US disclosed
US-9168253-B2 Quinazoline compounds HUTCHISON MEDIPHARMA LIMITED (CN) 2015-10-27 US disclosed
US-20130172373-A1 QUINAZOLINE COMPOUNDS HUTCHISON MEDIPHARMA LIMITED (CN) 2013-07-04 US disclosed
US-20130172373-A1 QUINAZOLINE COMPOUNDS HUTCHISON MEDIPHARMA LIMITED (CN) 2013-07-04 US disclosed
EP-2590966-A1 QUINAZOLINE COMPOUNDS Hutchison Medipharma Limited (CN) 2013-05-15 EP disclosed
WO-2012000356-A1 QUINAZOLINE COMPOUNDS HUTCHISON MEDIPHARMA LIMITED (CN) 2012-01-05 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-20130172373-A1 QUINAZOLINE COMPOUNDS EGFR, ABL1, ERBB2 EGFR 1/4885ERBB2 3/4885ERBB4 4/4885

“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.