SCHEMBL3249076

SCHEMBL3249076

COC(=O)c1c(NC(=O)Nc2ccc(C)s2)cc(C(C)(C)C)n1C

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 13/20 0.67
MAPK14 Q16539 12/20 0.67
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
P2RY1 P47900 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
SCHEMBL3245596 0.83 RAF1 (0.68) RAF1MAPK14
SCHEMBL3226707 0.80 MAPK14 (1.00) RAF1MAPK14
SCHEMBL3241657 0.79 MAPK14 (1.00) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL3226722 0.75 RAF1 (1.00) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL3237625 0.75 MAPK14 (1.00) RAF1MAPK14
SCHEMBL3242693 0.75 MAPK14 (1.00) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL4424145 0.69 MAPK14 (0.43) RAF1MAPK14
SCHEMBL3217612 0.66 MAPK14 (0.52) RAF1MAPK14
SCHEMBL10308265 0.64 MAPK14 (0.50) RAF1MAPK14
SCHEMBL668770 0.64 RAB9A (0.60) RAF1MAPK14MAPK13MAPK12MAPK11

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-20100160371-A1 INHIBITION OF P38 KINASE ACTIVITY BY ARYL UREAS RANGES GERALD 2010-06-24 US claimed
EP-1019040-B1 ARYL UREAS FOR THE TREATMENT OF INFLAMMATORY OR IMMUNOMODULATORY DISEASES BAYER AG (US) 2004-09-29 EP claimed
US-20020103253-A1 Inhibition of p38 kinase activity by aryl ureas BAYER CORPORATION (US) 2002-08-01 US claimed
US-6344476-B1 Inhibition of p38 kinase activity by aryl ureas BAYER CORPORATION 2002-02-05 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 (2 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-20020103253-A1 Inhibition of p38 kinase activity by aryl ureas MAPK1, MAP3K1, MAP3K7 RAF1 237/4885MAPK14 40/4885MAPK13 39/4885
US-20100160371-A1 INHIBITION OF P38 KINASE ACTIVITY BY ARYL UREAS MAPK1, MAP3K1, MAP3K7 RAF1 237/4885MAPK14 40/4885MAPK13 39/4885

“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.