SCHEMBL3970943

SCHEMBL3970943

Cc1cc(/C=C/C(=O)c2ccc(S(C)(=O)=O)cc2)c(OC(C)C)c(C)c1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.48
PTGS2 P35354 5/20 0.43
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
KRAS P01116 1/20 0.37
ABCG2 Q9UNQ0 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
SCHEMBL3969812 0.88 CAPN1 (0.45) MAOB
SCHEMBL1778808 0.87 CA1 (0.48) MAOBCA1CA2KRASABCG2
SCHEMBL498833 0.87 MAPT (0.44) MAOBCA1CA2
SCHEMBL3969980 0.87 CXCL12 (0.41) CA1CA2KRASABCG2
SCHEMBL499277 0.87 CA1 (0.48) MAOBCA1CA2KRASABCG2
SCHEMBL3972097 0.87 LMNA (0.46) CA1CA2KRASABCG2
SCHEMBL3964836 0.87 ALDH1A1 (0.48) MAOBCA1CA2KRASABCG2
SCHEMBL3970906 0.86 KRAS (0.51) MAOBKRASABCG2
SCHEMBL29386613 0.85 PPARG (0.47) MAOB
SCHEMBL498671 0.85 PPARG (0.47) MAOB

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-7566737-B2 Combinations of substituted 1,3-diphenylprop-2-en-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2009-07-28 US claimed
US-20070032543-A1 Combinations of substituted 1,3-diphenylprop-2-EN-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2007-02-08 US claimed
US-7566737-B2 Combinations of substituted 1,3-diphenylprop-2-en-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2009-07-28 US disclosed
US-20070032543-A1 Combinations of substituted 1,3-diphenylprop-2-EN-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2007-02-08 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-20070032543-A1 Combinations of substituted 1,3-diphenylprop-2-EN-1-one derivatives with other therapeutically active ingredients PSEN1, BACE1, PSEN2 MAOB 2058/4885PTGS2 168/4885CA1 4658/4885

“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.