SCHEMBL7030643

SCHEMBL7030643

Cc1ccc(C)c(C(=S)c2ccc(Nc3cnccc3C)cc2Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.44
MAPK14 Q16539 7/20 0.43
MAPK13 O15264 6/20 0.43
MAPK12 P53778 6/20 0.43
MAPK11 Q15759 6/20 0.43
PTGS1 P23219 2/20 0.43
PTGS2 P35354 2/20 0.43
KDM4E B2RXH2 2/20 0.40
KDM4C Q9H3R0 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.37
TDO2 P48775 1/20 0.37
CSF1R P07333 1/20 0.36

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
SCHEMBL7030742 0.87 MAPK14 (0.55) DHODHMAPK14MAPK13MAPK12MAPK11
SCHEMBL7030706 0.86 MAPK13 (0.57) DHODHMAPK14MAPK13MAPK12MAPK11
SCHEMBL7039001 0.85 CYP11B2 (0.43) MAPK14MAPK13MAPK12MAPK11PTGS1
SCHEMBL7037065 0.84 DHODH (0.43) DHODHMAPK14MAPK13MAPK12MAPK11
SCHEMBL7037795 0.83 MAPK14 (0.45) MAPK14MAPK13MAPK12MAPK11PTGS1
SCHEMBL7035323 0.82 ADRA2A (0.43) DHODHMAPK14MAPK13MAPK12MAPK11
SCHEMBL7075155 0.80 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11PTGS1
SCHEMBL7072894 0.78 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL7034038 0.76 MAPK14 (0.76) DHODHMAPK14MAPK13MAPK12MAPK11
SCHEMBL7036392 0.74 MAPK14 (0.53) DHODHMAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6432962-B2 Benzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-08-13 US claimed
EP-1289958-A2 BENZOPHENONES AS INHIBITORS OF IL-1$g(b) AND TNF-$g(a) Leo Pharma A/S (DK) 2003-03-12 EP disclosed
US-6432962-B2 Benzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-08-13 US disclosed
US-20020016347-A1 Benzophenones as inhibitors of IL-1beta and TNF-alpha LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-02-07 US disclosed
WO-2001090074-A2 BENZOPHENONES AS INHIBITORS OF IL-1β AND TNF-$g(a) LEO PHARMA A/S (DK) 2001-11-29 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-20020016347-A1 Benzophenones as inhibitors of IL-1beta and TNF-alpha IL1B, IL1A, NFKBIA DHODH 2573/4885MAPK14 625/4885MAPK13 1908/4885

“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.