SCHEMBL6098084

SCHEMBL6098084

Cc1ccccc1C(=O)c1ccc(Nc2ccccc2CC[C@H](CO)NC(=O)O)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.62
MAPK13 O15264 13/20 0.62
MAPK12 P53778 13/20 0.62
MAPK11 Q15759 13/20 0.62
EPHX2 P34913 1/20 0.38
AVPR2 P30518 2/20 0.38
OXTR P30559 2/20 0.38
AVPR1A P37288 2/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
PTGS2 P35354 1/20 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
SCHEMBL6098086 1.00 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11EPHX2
SCHEMBL6093762 0.85 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL5172447 0.84 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL6097137 0.83 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL6094908 0.83 MAPK14 (0.77) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL6096364 0.82 MAPK14 (0.39) MAPK14MAPK13MAPK12MAPK11EPHX2
SCHEMBL6096529 0.81 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL6097268 0.81 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL6096931 0.80 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11SIRT2
SCHEMBL6097838 0.80 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11AVPR2

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-7034015-B2 Interleukin 1 beta and tumour necrosis factor alpha inhibitors LEO PHARMA A/S (DK) 2006-04-25 US claimed
US-20030119902-A1 Interleukin 1 beta and tumour necrosis factor alpha inhibitors LEO PHARMA A/S (DK) 2003-06-26 US claimed
US-7034015-B2 Interleukin 1 beta and tumour necrosis factor alpha inhibitors LEO PHARMA A/S (DK) 2006-04-25 US disclosed
US-20030119902-A1 Interleukin 1 beta and tumour necrosis factor alpha inhibitors LEO PHARMA A/S (DK) 2003-06-26 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-20030119902-A1 Interleukin 1 beta and tumour necrosis factor alpha inhibitors IL1B, IL1A, TNF MAPK14 1972/4885MAPK13 2918/4885MAPK12 2155/4885

“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.