SCHEMBL5428304

SCHEMBL5428304

NCc1ccc(NC(=O)c2cnc3ccc(Oc4ccnc(C5=NCCN5)c4)cc3c2)cc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 3/20 0.44
BRAF P15056 3/20 0.44
SRC P12931 4/20 0.41
ABL1 P00519 4/20 0.41
EGFR P00533 2/20 0.39
KDR P35968 6/20 0.39
RET P07949 2/20 0.39
FLT1 P17948 1/20 0.39
MAPK14 Q16539 2/20 0.38
MAP3K7 O43318 1/20 0.38
MAP4K2 Q12851 1/20 0.38
NTRK1 P04629 1/20 0.38
TEK Q02763 1/20 0.38
NTRK2 Q16620 1/20 0.38
MAP3K20 Q9NYL2 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
SCHEMBL5416351 0.90 RAF1 (0.45) RAF1BRAFSRCABL1KDR
SCHEMBL5418586 0.89 RAF1 (0.51) RAF1BRAFSRCABL1EGFR
SCHEMBL544981 0.86 KDR (0.43) RAF1BRAFSRCABL1EGFR
SCHEMBL545259 0.85 BRAF (0.46) RAF1BRAFKDR
SCHEMBL5425682 0.83 KDR (0.42) RAF1BRAFSRCABL1EGFR
SCHEMBL5423039 0.82 BRAF (0.60) RAF1BRAFSRCABL1EGFR
SCHEMBL545439 0.82 MAPK14 (0.44) RAF1BRAFSRCABL1EGFR
SCHEMBL546229 0.80 MAPK14 (0.50) RAF1BRAFSRCABL1EGFR
SCHEMBL5430237 0.79 BRAF (0.49) RAF1BRAFSRCKDRFLT1
SCHEMBL545423 0.79 MAPK14 (0.49) RAF1BRAFSRCABL1EGFR

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 RAF1 198/4885BRAF 215/4885SRC 180/4885

“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.