SCHEMBL4367761

SCHEMBL4367761

CC(C)(C)c1ccc(Nc2nc3cc(Oc4ccncc4)ccc3[nH]2)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.48
RAF1 P04049 8/20 0.43
BRAF P15056 7/20 0.43
CSNK1D P48730 5/20 0.42
CSNK1G2 P78368 4/20 0.41
TEK Q02763 2/20 0.37
MAPK14 Q16539 3/20 0.36
CSNK1A1 P48729 1/20 0.35
GSK3B P49841 1/20 0.35
CYP3A4 P08684 1/20 0.34

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
SCHEMBL4364801 0.84 RAF1 (0.58) KDRRAF1BRAFCSNK1DCSNK1G2
SCHEMBL13861947 0.76 KDR (0.61) KDRRAF1BRAFCSNK1DCSNK1G2
SCHEMBL2890387 0.76 RAF1 (0.67) KDRRAF1BRAF
SCHEMBL4364072 0.74 KDR (0.61) KDRRAF1BRAFCSNK1DCSNK1A1
SCHEMBL4372559 0.73 KDR (0.85) KDRRAF1BRAFCSNK1DCSNK1G2
SCHEMBL4370234 0.73 KDR (0.55) KDRRAF1BRAFCSNK1DTEK
SCHEMBL4369261 0.73 CSNK1A1 (0.54) KDRRAF1BRAFCSNK1DTEK
SCHEMBL4161669 0.72 KDR (0.56) KDRRAF1BRAFCSNK1DCSNK1G2
SCHEMBL13862513 0.71 KDR (0.61) KDRRAF1BRAFCSNK1DCSNK1G2
SCHEMBL4367856 0.71 KDR (0.55) KDRRAF1BRAFCSNK1DCSNK1G2

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-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 US disclosed
US-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 US disclosed
EP-1638954-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC. (US) 2006-03-29 EP disclosed
US-20040209892-A1 Heterocyclic compounds and methods of use U.S. PATENT OPERATIONS 2004-10-21 US disclosed
WO-2004085425-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC (US) 2004-10-07 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-20040209892-A1 Heterocyclic compounds and methods of use VHL, NQO1, HPGDS KDR 83/4885RAF1 1846/4885BRAF 612/4885

“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.