SCHEMBL29557065

SCHEMBL29557065

COc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)oc3n2)c1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 10/20 0.73
▸ FGFR1 P11362 7/20 0.66
▸ EGFR P00533 6/20 0.66
▸ SRC P12931 4/20 0.54
▸ WEE1 P30291 2/20 0.50
▸ LCK P06239 1/20 0.50
▸ PIK3CA P42336 1/20 0.49
▸ PIK3CB P42338 1/20 0.49
▸ PIK3CG P48736 1/20 0.49
▸ FGFR2 P21802 2/20 0.49
▸ FGFR4 P22455 2/20 0.49
▸ FGFR3 P22607 2/20 0.49
▸ PDGFRB P09619 1/20 0.48
▸ PDGFRA P16234 1/20 0.48
▸ MAPK14 Q16539 1/20 0.48

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
SCHEMBL19662129 1.00 ABL1 (0.73) ABL1FGFR1EGFRSRCWEE1
SCHEMBL19662126 0.85 ABL1 (1.00) ABL1FGFR1EGFRSRCWEE1
SCHEMBL29557319 0.85 ABL1 (1.00) ABL1FGFR1EGFRSRCWEE1
SCHEMBL29557330 0.84 ABL1 (0.73) ABL1FGFR1EGFRSRCWEE1
SCHEMBL29557037 0.84 ABL1 (0.73) ABL1FGFR1EGFRSRCWEE1
SCHEMBL19662128 0.84 ABL1 (0.73) ABL1FGFR1EGFRSRCWEE1
SCHEMBL29557067 0.84 ABL1 (0.83) ABL1FGFR1EGFRSRCWEE1
SCHEMBL23877670 0.83 ABL1 (1.00) ABL1FGFR1EGFRSRCWEE1
SCHEMBL29557024 0.83 ABL1 (1.00) ABL1FGFR1EGFRSRCWEE1
SCHEMBL19662127 0.82 ABL1 (0.73) ABL1FGFR1EGFRSRCWEE1

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-20220096485-A1 FUNCTIONALIZED PYRANO[2,3-D]PYRIMIDIN-7-ONE DERIVATIVES AND METHODS FOR THEIR PREPARATION AND USE THE TEXAS A&M UNIVERSITY SYSTEM (US) 2022-03-31 — — 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-20220096485-A1 FUNCTIONALIZED PYRANO[2,3-D]PYRIMIDIN-7-ONE DERIVATIVES AND METHODS FOR THEIR PREPARATION AND USE MAP3K7, MAP4K2, MAP3K8 ABL1 145/4885FGFR1 666/4885EGFR 1130/4885

“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.

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