SCHEMBL3973677

SCHEMBL3973677

Cc1cc(/C=C/C(=O)c2ccccc2OC(F)(F)F)c(OC(C)C)c(C)c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 4/20 0.44
KCNK9 Q9NPC2 4/20 0.44
MAOB P27338 3/20 0.43
MAOA P21397 1/20 0.43
AR P10275 2/20 0.41
ABCB1 P08183 1/20 0.39
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
APP P05067 1/20 0.35
ANO1 Q5XXA6 1/20 0.35

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
SCHEMBL499194 0.88 ABCB1 (0.52) MAOBARABCB1ALDH1A1LMNA
SCHEMBL498756 0.83 MAPT (0.50) MAOBMAOAARALDH1A1LMNA
SCHEMBL29382056 0.83 CYP1A1 (0.39) MAOBLMNAMAPTABCG2
SCHEMBL1933383 0.83 CYP1A1 (0.39) MAOBLMNAMAPTABCG2
SCHEMBL3962818 0.81 MEN1 (0.43) ARLMNAMAPT
SCHEMBL3970021 0.81 ABCB1 (0.43) ARABCB1ALDH1A1LMNAMAPT
SCHEMBL3964836 0.79 ALDH1A1 (0.48) MAOBMAOAALDH1A1LMNAMAPT
SCHEMBL1935354 0.79 CYP1A1 (0.53) MAOB
SCHEMBL29379151 0.79 CYP1A1 (0.53) MAOB
SCHEMBL498651 0.78 ABCB1 (0.47) MAOBARABCB1ALDH1A1LMNA

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 KCNK3 4103/4885KCNK9 4514/4885MAOB 2058/4885

“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.