SCHEMBL3242997

SCHEMBL3242997

COC(=O)c1cc(C(C)(C)C)sc1N=C=O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 13/20 0.38
MAPK14 Q16539 8/20 0.38
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 2/20 0.35
PKM P14618 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL10710912 0.80 CNR2 (0.43) MAPTMEN1ALDH1A1GAAHPGD
SCHEMBL10712552 0.77 RAF1 (0.37) RAF1MAPTMEN1ALDH1A1GAA
SCHEMBL10713757 0.77 ALDH1A1 (0.48) MAPTPKMMEN1ALDH1A1GAA
SCHEMBL3245224 0.77 RAF1 (0.46) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL3206449 0.76 GAA (0.53) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL167135 0.74 RAF1 (0.45) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL10717074 0.73 ALDH1A1 (0.64) L3MBTL1MAPTMEN1ALDH1A1GAA
SCHEMBL10706597 0.69 KMT2A (0.45) L3MBTL1MAPTMEN1ALDH1A1KMT2A
SCHEMBL10264809 0.67 L3MBTL1 (0.53) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL4118040 0.67 CA12 (0.43) L3MBTL1MAPTALDH1A1GAAHPGD

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 7 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 disclosed
EP-1019040-B1 ARYL UREAS FOR THE TREATMENT OF INFLAMMATORY OR IMMUNOMODULATORY DISEASES BAYER AG (US) 2004-09-29 EP disclosed
US-20020103253-A1 Inhibition of p38 kinase activity by aryl ureas BAYER CORPORATION (US) 2002-08-01 US disclosed
US-6344476-B1 Inhibition of p38 kinase activity by aryl ureas BAYER CORPORATION 2002-02-05 US disclosed
EP-1019040-A4 INHIBITION OF p38 KINASE ACTIVITY BY ARYL UREAS BAYER AG (US) 2000-10-04 EP disclosed
EP-1019040-A1 INHIBITION OF p38 KINASE ACTIVITY BY ARYL UREAS Bayer Corporation (US) 2000-07-19 EP disclosed
WO-1998052558-A1 INHIBITION OF p38 KINASE ACTIVITY BY ARYL UREAS BAYER CORPORATION (US) 1998-11-26 WO 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 (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.