SCHEMBL5059872

SCHEMBL5059872

CC(C)n1cc(NC(=O)Nc2ccc(Oc3ccnc(-c4cn[nH]c4)c3)cc2)c(-c2ccc3oncc3c2)n1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.44
AXL P30530 1/20 0.40
ROCK2 O75116 1/20 0.40
FLT1 P17948 2/20 0.38
RAF1 P04049 2/20 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
SCHEMBL5052132 0.92 AXL (0.41) KDRAXLFLT1
SCHEMBL5054943 0.90 KDR (0.44) KDRFLT1RAF1
SCHEMBL5062137 0.88 KDR (0.45) KDRAXLROCK2FLT1
SCHEMBL5052318 0.88 KDR (0.45) KDRAXLROCK2FLT1
SCHEMBL5054888 0.86 KDR (0.44) KDRAXLROCK2FLT1
SCHEMBL5140140 0.86 KDR (0.51) KDRAXLROCK2FLT1RAF1
SCHEMBL5054508 0.85 KDR (0.37) KDRRAF1
SCHEMBL5054970 0.85 MAPK14 (0.43) KDR
SCHEMBL5055362 0.85 RAF1 (0.49) KDRAXLFLT1RAF1
SCHEMBL5055243 0.84 KDR (0.48) KDRAXLROCK2FLT1

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 KDR 41/4885AXL 117/4885ROCK2 287/4885

“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.