SCHEMBL19220791

SCHEMBL19220791

COc1cc2c(Nc3ccc(F)c(C)c3)ncnc2cc1OCCCCN(C)C

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.77
RET P07949 2/20 0.66
KIF5B P33176 1/20 0.66
KDR P35968 1/20 0.62

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
SCHEMBL19006946 0.97 EGFR (0.81) EGFRRETKIF5BKDR
SCHEMBL17520361 0.90 EGFR (0.94) EGFRKDR
SCHEMBL8789 0.89 EGFR (0.84) EGFRRETKIF5BKDR
SCHEMBL25707230 0.87 RET (0.68) EGFRRETKIF5BKDR
SCHEMBL2102985 0.87 EGFR (1.00) EGFRKDR
SCHEMBL17520337 0.87 EGFR (1.00) EGFRKDR
SCHEMBL19220797 0.85 HDAC3 (0.69) EGFRKDR
SCHEMBL19220795 0.84 HDAC3 (0.69) EGFRKDR
SCHEMBL11113 0.84 EGFR (1.00) EGFRKDR
SCHEMBL13498209 0.84 EGFR (0.64) EGFRRETKIF5BKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170226099-A1 QUINAZOLINE DERIVATIVE CSPC ZHONGQI PHARMACEUTICAL TECHNOLOGY (SHIJIAZHUANG) CO., LTD. (CN) 2017-08-10 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 (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-20170226099-A1 QUINAZOLINE DERIVATIVE H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TOP2A, TOP1 EGFR 3701/4885RET 4595/4885KIF5B 1385/4885

“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.