SCHEMBL13485436

SCHEMBL13485436

COc1cc2ncnc(Nc3c(CN(CCCCCCl)C(=O)OCc4ccccc4)ccc4c3OCO4)c2cc1O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 11/20 0.43
▸ KDR P35968 8/20 0.43
▸ CSK P41240 3/20 0.43
▸ TEK Q02763 3/20 0.43
▸ EPHB4 P54760 1/20 0.43
▸ EGFR P00533 6/20 0.42
▸ FYN P06241 1/20 0.41
▸ AURKB Q96GD4 2/20 0.38
▸ RAF1 P04049 1/20 0.38
▸ BRAF P15056 1/20 0.38
▸ AURKA O14965 1/20 0.37

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
SCHEMBL13485435 0.92 KDR (0.46) SRCKDRCSKTEKEPHB4
SCHEMBL13485493 0.90 EGFR (0.42) SRCKDREGFRAURKBAURKA
SCHEMBL13485434 0.87 SRC (0.44) SRCKDRCSKTEKEPHB4
SCHEMBL13485512 0.85 EGFR (0.39) SRCKDREGFRFYNAURKB
SCHEMBL13485492 0.84 EGFR (0.41) SRCKDRCSKTEKEPHB4
SCHEMBL13485511 0.79 EGFR (0.38) SRCKDRCSKTEKEPHB4
SCHEMBL13485489 0.79 EGFR (0.41) SRCKDRCSKTEKEPHB4
SCHEMBL13485466 0.77 SRC (0.47) SRCKDRCSKTEKEPHB4
SCHEMBL13485446 0.77 KDR (0.50) SRCKDRCSKTEKEPHB4
SCHEMBL6583527 0.72 KDR (0.74) SRCKDRCSKTEKEPHB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492377-B2 MTKI quinazoline derivatives JANSSEN PHARMACEUTICA NV (BE) 2013-07-23 — — US disclosed
US-8492377-B2 MTKI quinazoline derivatives JANSSEN PHARMACEUTICA NV (BE) 2013-07-23 — — US disclosed
US-20100029627-A1 MTKI QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2010-02-04 — — US disclosed
US-20100029627-A1 MTKI QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2010-02-04 — — 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-20100029627-A1 MTKI QUINAZOLINE DERIVATIVES NR4A3, NR4A1, NR5A2 SRC 1853/4885KDR 1987/4885CSK 698/4885

“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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