SCHEMBL5418754

SCHEMBL5418754

CC(C(=O)Nc1cc(Oc2ccc3ccc(C(=O)Nc4cccc(C(C)(C)C)c4)cc3c2)ccn1)N1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.48
FGFR1 P11362 2/20 0.47
KDR P35968 2/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
PDGFRB P09619 1/20 0.46
KIT P10721 1/20 0.46
SRC P12931 1/20 0.46
FLT1 P17948 1/20 0.46
FLT4 P35916 1/20 0.46
RAF1 P04049 3/20 0.45
WNT3A P56704 5/20 0.44
GSK3B P49841 1/20 0.41
DYRK1A Q13627 1/20 0.41

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
SCHEMBL545071 0.93 BRAF (0.50) BRAFFGFR1KDRLCKFYN
SCHEMBL545882 0.92 BRAF (0.51) BRAFFGFR1KDRLCKFYN
SCHEMBL5436373 0.84 MAPK14 (0.47) BRAFFGFR1KDRLCKFYN
SCHEMBL4643326 0.82 BRAF (0.54) BRAFKDRLCKFYNPDGFRB
SCHEMBL5423590 0.82 BRAF (0.62) BRAFKDRLCKFYNPDGFRB
SCHEMBL545450 0.82 BRAF (0.50) BRAFFGFR1KDRLCKFYN
SCHEMBL10200829 0.81 BRAF (0.48) BRAFFGFR1KDRLCKFYN
SCHEMBL545127 0.81 BRAF (0.54) BRAFFGFR1KDRLCKFYN
SCHEMBL544977 0.80 BRAF (0.51) BRAFKDRLCKFYNPDGFRB
SCHEMBL10200809 0.80 BRAF (0.51) BRAFKDRLCKFYNPDGFRB

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-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-28 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-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MAP3K20, MAP3K1, MAP3K5 BRAF 215/4885FGFR1 580/4885KDR 1264/4885

“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.