SCHEMBL5651946

SCHEMBL5651946

COCCOc1cc2ncnc(Nc3cc(Cl)c(N4CCN(Cc5ccccc5)CC4)c(C4=CC(=O)C=CC4=O)c3)c2cc1OC

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.64
EPHA2 P29317 5/20 0.48
EPHB4 P54760 4/20 0.48
ERBB2 P04626 2/20 0.48
ACHE P22303 1/20 0.47
BACE1 P56817 1/20 0.47
EGFR P00533 4/20 0.47
NSD2 O96028 1/20 0.46

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
SCHEMBL5654029 0.95 KDR (0.57) KDREPHA2EPHB4ERBB2EGFR
SCHEMBL5653360 0.89 KDR (0.65) KDREPHA2EPHB4ERBB2ACHE
SCHEMBL5649066 0.85 KDR (0.58) KDREGFR
SCHEMBL5651585 0.84 KDR (0.55) KDREPHA2EPHB4EGFR
SCHEMBL5648562 0.82 KDR (0.56) KDRERBB2EGFR
SCHEMBL5649229 0.82 KDR (0.65) KDREPHA2ERBB2EGFR
SCHEMBL5652981 0.82 KDR (0.57) KDREPHA2EPHB4EGFR
SCHEMBL5648577 0.81 KDR (0.64) KDREGFR
SCHEMBL5648569 0.81 KDR (0.61) KDREGFR
SCHEMBL5650446 0.80 KDR (0.65) KDREPHA2ERBB2EGFR

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-20070299092-A1 Quinone Substituted Quinazoline and Quinoline Kinase Inhibitors WYETH (US) 2007-12-27 US claimed

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-20070299092-A1 Quinone Substituted Quinazoline and Quinoline Kinase Inhibitors KDR, FLT1, FLT4 KDR 1/4885EPHA2 814/4885EPHB4 1167/4885

“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.