SCHEMBL5651729

SCHEMBL5651729

COCCOc1cc(N=CN(C)C)c(C#N)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRC P12931 6/20 0.40
ALDH1A1 P00352 1/20 0.37
FDPS P14324 1/20 0.36
EGFR P00533 3/20 0.35
ABL1 P00519 1/20 0.35
FLT1 P17948 1/20 0.35
KDR P35968 1/20 0.35
SYK P43405 1/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
GAA P10253 1/20 0.35
AR P10275 2/20 0.34
ERBB2 P04626 2/20 0.34
MAPT P10636 1/20 0.34
PDPK1 O15530 1/20 0.33
PRKCQ Q04759 1/20 0.33

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
SCHEMBL5651723 1.00 SRC (0.40) SRCALDH1A1FDPSEGFRABL1
SCHEMBL482256 0.96 GAA (0.37) SRCALDH1A1EGFRMAOBGAA
SCHEMBL14345814 0.96 GAA (0.37) SRCALDH1A1EGFRMAOBGAA
SCHEMBL482255 0.96 GAA (0.37) SRCALDH1A1EGFRMAOBGAA
SCHEMBL29986851 0.96 GAA (0.37) SRCALDH1A1EGFRMAOBGAA
SCHEMBL15365246 0.93 AR (0.39) SRCEGFRMAOBGAAAR
SCHEMBL15365458 0.93 AR (0.39) SRCEGFRMAOBGAAAR
SCHEMBL15365315 0.93 AR (0.39) SRCEGFRMAOBGAAAR
SCHEMBL15365401 0.93 AR (0.39) SRCEGFRMAOBGAAAR
SCHEMBL5042200 0.89 MAOB (0.34) SRCALDH1A1FDPSABL1MAOA

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 2 patents. 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 disclosed
WO-2005115145-A2 QUINONE SUBSTITUTED QUINAZOLINE AND QUINOLINE KINASE INHIBITORS WYETH (US) 2005-12-08 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-20070299092-A1 Quinone Substituted Quinazoline and Quinoline Kinase Inhibitors KDR, FLT1, FLT4 SRC 960/4885ALDH1A1 530/4885FDPS 1910/4885

“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.