SCHEMBL5052253

SCHEMBL5052253

CC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cn(C(C)(C)C)nc3-c3ccc4scnc4c3)cc2)ccn1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.44
MAPK13 O15264 3/20 0.44
BRAF P15056 9/20 0.41
KDR P35968 9/20 0.41
LCK P06239 2/20 0.40
RIPK2 O43353 1/20 0.40
TGFBR1 P36897 1/20 0.40
FYN P06241 1/20 0.38
PDGFRB P09619 1/20 0.38
KIT P10721 1/20 0.38
SRC P12931 1/20 0.38
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38

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
SCHEMBL5052398 0.91 KDR (0.39) MAPK14MAPK13BRAFKDRLCK
SCHEMBL5055345 0.91 MAPK14 (0.56) MAPK14MAPK13BRAFKDR
SCHEMBL5056265 0.91 KDR (0.38) MAPK14MAPK13BRAFKDRLCK
SCHEMBL5056399 0.89 MAPK14 (0.44) MAPK14MAPK13BRAFKDRLCK
SCHEMBL5056567 0.87 RAF1 (0.51) MAPK14MAPK13BRAFKDRLCK
SCHEMBL5055302 0.85 MAPK14 (0.44) MAPK14MAPK13BRAFKDRLCK
SCHEMBL5060550 0.85 MAPK14 (0.44) MAPK14MAPK13BRAFKDRLCK
SCHEMBL5056301 0.85 KDR (0.43) KDRFLT1
SCHEMBL5056645 0.84 ABL1 (0.49) MAPK14MAPK13BRAFKDRLCK
SCHEMBL5054956 0.83 MAPK14 (0.45) MAPK14MAPK13BRAFKDRLCK

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-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 US claimed

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-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 MAPK14 100/4885MAPK13 118/4885BRAF 2/4885

“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.