SCHEMBL4375281

SCHEMBL4375281

CNC(=O)c1cc(Oc2ccc3c(c2)nc(Nc2ccc(Cl)c(CN4CCN(C)CC4)c2)n3C)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 1.00
RAF1 P04049 13/20 0.68
BRAF P15056 13/20 0.68
LCK P06239 1/20 0.60
FYN P06241 1/20 0.60
PDGFRB P09619 1/20 0.60
KIT P10721 1/20 0.60
FLT1 P17948 1/20 0.60
FLT4 P35916 1/20 0.60
MAPK14 Q16539 2/20 0.59

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
SCHEMBL5806990 0.92 KDR (0.86) KDRRAF1BRAFLCKFYN
SCHEMBL2893587 0.87 KDR (0.77) KDRRAF1BRAFLCKFYN
SCHEMBL13209815 0.85 RAF1 (0.81) KDRRAF1BRAFLCKFYN
SCHEMBL4374828 0.85 KDR (1.00) KDRRAF1BRAFLCKKIT
SCHEMBL4367758 0.85 KDR (0.89) KDRRAF1BRAFMAPK14
SCHEMBL2893984 0.84 KDR (0.73) KDRRAF1BRAFLCKFYN
SCHEMBL24007771 0.84 KDR (0.72) KDRRAF1BRAFLCKFYN
SCHEMBL3011073 0.84 RAF1 (0.76) KDRRAF1BRAFLCKFYN
SCHEMBL2890446 0.84 RAF1 (0.79) KDRRAF1BRAFLCKFYN
SCHEMBL4362767 0.84 KDR (1.00) KDRRAF1BRAFLCKKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040209892-A1 Heterocyclic compounds and methods of use U.S. PATENT OPERATIONS 2004-10-21 US claimed
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
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.