SCHEMBL3970599

SCHEMBL3970599

CCCOc1ccc(C(=O)C=Cc2cc(C)c(O)c(C)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 3/20 0.70
PTGS1 P23219 1/20 0.69
PTGS2 P35354 1/20 0.69
CYP1A1 P04798 1/20 0.61
CYP1B1 Q16678 1/20 0.61
MAOB P27338 2/20 0.55
BCHE P06276 1/20 0.55
ACHE P22303 1/20 0.55

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
SCHEMBL3970596 1.00 ABCG2 (0.70) ABCG2PTGS1PTGS2CYP1A1CYP1B1
SCHEMBL498717 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL498718 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL3969188 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL4217390 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL3969259 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL3969187 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL3969256 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL4217391 0.91 ABCG2 (0.66) ABCG2PTGS1PTGS2BCHEACHE
SCHEMBL13764738 0.90 MAOB (0.69) ABCG2MAOB

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 2 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 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 ABCG2 2957/4885PTGS1 98/4885PTGS2 168/4885

“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.