SCHEMBL4937778

SCHEMBL4937778

CNc1cc(Oc2ccc(NC(=O)Nc3cc(CN4CCN(C(C)C)CC4)cc(C(F)(F)F)c3)cc2)ncn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.61
TNNI3K Q59H18 15/20 0.61
MAPK14 Q16539 14/20 0.61
BRAF P15056 12/20 0.61
MKNK2 Q9HBH9 3/20 0.61
RAF1 P04049 2/20 0.61
MKNK1 Q9BUB5 2/20 0.61
STK25 O00506 1/20 0.61
CIT O14578 1/20 0.61
MAP2K7 O14733 1/20 0.61
IKBKB O14920 1/20 0.61
AURKA O14965 1/20 0.61
GAK O14976 1/20 0.61
CHUK O15111 1/20 0.61
MUSK O15146 1/20 0.61
MAPK13 O15264 1/20 0.61
MAP3K13 O43283 1/20 0.61
DAPK3 O43293 1/20 0.61
MAP3K7 O43318 1/20 0.61
RIPK2 O43353 1/20 0.61

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
SCHEMBL4769465 0.91 KDR (0.65) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL4937968 0.91 KDR (0.69) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL4935608 0.91 KDR (0.56) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL4771607 0.91 KDR (0.70) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL4938328 0.90 KDR (0.59) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL13991480 0.88 KDR (0.53) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL13991078 0.86 KDR (0.51) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL13991080 0.85 MAPK14 (0.84) KDRTNNI3KMAPK14BRAFMKNK2
SCHEMBL12972242 0.84 KDR (0.45) KDRTNNI3KMAPK14BRAFMKNK2
Trifluoroacetic Acid SCHEMBL4929655 0.83 KDR (0.79) KDRTNNI3KMAPK14BRAFMKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 US claimed
US-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 US disclosed
US-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 US disclosed
US-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 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-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases RET, PRKDC, PRKACA KDR 1309/4885TNNI3K 314/4885MAPK14 343/4885

“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.