SCHEMBL4512105

SCHEMBL4512105

Cc1ccc(C(=O)NCC2CC2)cc1-c1ccc2c(c1)CC(C)(C)C2=O

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.67
HSPB1 P04792 1/20 0.60
CYP2C9 P11712 1/20 0.60
MAPK11 Q15759 1/20 0.60

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
SCHEMBL4501828 0.90 MAPK14 (0.64) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL4504889 0.84 MAPK14 (0.60) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL4499326 0.84 MAPK14 (0.49) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL3052171 0.83 MAPK14 (0.49) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL4503633 0.83 ALDH1A1 (0.50) MAPK14
SCHEMBL5632508 0.81 MAPK14 (1.00) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL4503416 0.81 MAPK14 (0.55) MAPK14CYP2C9
SCHEMBL4516470 0.80 RXRA (0.51) MAPK14
SCHEMBL4502525 0.79 MAPK14 (0.53) MAPK14
SCHEMBL4516090 0.78 ALDH1A1 (0.47) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286775-A1 Bicyclic Derivatives as P38 Kinase Inhibitors PALAU PHARMA, S.A. (ES) 2009-11-19 US claimed
CN-101208301-A Bicyclic derivatives as p38 kinase inhibitors PALAU PHARMA SA (ES) 2008-06-25 CN claimed
EP-1917241-A2 BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS Palau Pharma, S.A. (ES) 2008-05-07 EP claimed
WO-2007000339-A1 BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS PALAU PHARMA, S.A. (ES) 2007-01-04 WO claimed
US-20090286775-A1 Bicyclic Derivatives as P38 Kinase Inhibitors PALAU PHARMA, S.A. (ES) 2009-11-19 US disclosed
CN-101208301-A Bicyclic derivatives as p38 kinase inhibitors PALAU PHARMA SA (ES) 2008-06-25 CN disclosed
EP-1917241-A2 BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS Palau Pharma, S.A. (ES) 2008-05-07 EP disclosed
WO-2007000339-A1 BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS PALAU PHARMA, S.A. (ES) 2007-01-04 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 (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-20090286775-A1 Bicyclic Derivatives as P38 Kinase Inhibitors MAPK1, MAPKAPK2, MAPKAPK3 MAPK14 26/4885HSPB1 643/4885CYP2C9 3389/4885

“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.