SCHEMBL3948346

SCHEMBL3948346

COc1cc2c(Nc3nc4ccc(NC(=O)Nc5ccc(Cl)c(C(F)(F)F)c5)cc4s3)ncnc2cc1OCCCN(C)C

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.60
KDR P35968 9/20 0.60
BRAF P15056 6/20 0.60
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
RAF1 P04049 2/20 0.51
FLT1 P17948 1/20 0.49
FLT4 P35916 1/20 0.49
KIT P10721 1/20 0.49
ERBB2 P04626 1/20 0.47

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
SCHEMBL3947811 0.97 KDR (0.59) EGFRKDRBRAFCA2CA9
SCHEMBL13881876 0.93 EGFR (0.51) EGFRKDRBRAFCA2CA9
SCHEMBL3948976 0.92 BRAF (0.60) EGFRKDRBRAFCA2CA9
SCHEMBL3945598 0.88 KDR (0.72) EGFRKDRBRAFFLT1FLT4
SCHEMBL3947634 0.88 KDR (0.72) EGFRKDRBRAFFLT1FLT4
SCHEMBL3953829 0.88 KDR (0.71) EGFRKDRBRAFFLT1FLT4
SCHEMBL3954138 0.88 KDR (0.71) EGFRKDRBRAFFLT1FLT4
SCHEMBL3946977 0.87 EGFR (0.66) EGFRKDRBRAFRAF1FLT1
SCHEMBL3945278 0.87 EGFR (0.66) EGFRKDRBRAFRAF1FLT1
SCHEMBL3945583 0.87 KDR (0.81) EGFRKDRBRAFRAF1FLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
US-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
EP-1885719-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2008-02-13 EP disclosed
WO-2006066795-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2006-06-29 WO disclosed
US-20060135782-A1 Benzazole analogues and uses thereof 4SC AG (DE) 2006-06-22 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-20060135782-A1 Benzazole analogues and uses thereof DCK, SBK3, DAPK3 EGFR 437/4885KDR 1657/4885BRAF 15/4885

“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.