SCHEMBL3969740

SCHEMBL3969740

CC(C)Oc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSL P07711 6/20 0.60
CTSB P07858 6/20 0.60
TDP1 Q9NUW8 1/20 0.60
CAPN1 P07384 3/20 0.56
MAOB P27338 1/20 0.56
CHRNA7 P36544 1/20 0.52
CYP1A1 P04798 1/20 0.49
CYP1B1 Q16678 1/20 0.49
DPP4 P27487 3/20 0.49
BACE1 P56817 1/20 0.48
PTPN1 P18031 3/20 0.48
TNFRSF1A P19438 1/20 0.47

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
SCHEMBL7186825 0.88 CTSL (0.61) CTSLCTSBTDP1CAPN1MAOB
SCHEMBL7186830 0.88 CTSL (0.61) CTSLCTSBTDP1CAPN1MAOB
SCHEMBL498959 0.87 NR1H4 (0.59) CTSLCTSBTDP1CAPN1CHRNA7
SCHEMBL498780 0.86 MAPT (0.46) CTSLCTSBTDP1TNFRSF1A
SCHEMBL499474 0.83 AR (0.58) MAOBCHRNA7
SCHEMBL7186683 0.82 CAPN1 (0.56) CTSLCTSBTDP1CAPN1MAOB
SCHEMBL7186678 0.82 CAPN1 (0.56) CTSLCTSBTDP1CAPN1MAOB
SCHEMBL7192416 0.81 PTPN1 (0.56) CTSLCTSBTDP1CAPN1MAOB
SCHEMBL7192414 0.81 PTPN1 (0.56) CTSLCTSBTDP1CAPN1MAOB
SCHEMBL498877 0.80 MAPT (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 CTSL 2649/4885CTSB 734/4885TDP1 557/4885

“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.