SCHEMBL2829889

SCHEMBL2829889

CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](O)COC(=O)C=Cc1ccc(O)c(OC)c1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.55
▸ PPARG P37231 1/20 0.55
▸ HTR1A P08908 3/20 0.54
▸ TRPV1 Q8NER1 3/20 0.54
▸ TOP2A P11388 1/20 0.52
▸ DGKA P23743 1/20 0.51
▸ MEN1 O00255 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ MTOR P42345 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ LPAR1 Q92633 2/20 0.49
▸ MET P08581 1/20 0.49

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
SCHEMBL2837789 0.91 PPARG (0.55) MAOBPPARGHTR1ATRPV1TOP2A
SCHEMBL2832869 0.89 MAOB (0.55) MAOBPPARGHTR1ATRPV1TOP2A
Oleic Acid SCHEMBL27768091 0.89 HTR1A (0.54) MAOBPPARGHTR1ATRPV1DGKA
Glyceryl Monooleate SCHEMBL27768092 0.89 DGKA (0.59) PPARGHTR1ATRPV1TOP2ADGKA
SCHEMBL7696903 0.88 TRPV1 (0.53) HTR1ATRPV1DGKAMEN1TP53
SCHEMBL2833864 0.87 PRKCA (0.57) MAOBPPARGHTR1ATRPV1TOP2A
SCHEMBL9063847 0.86 HTR1A (0.61) MAOBPPARGHTR1ATRPV1TOP2A
SCHEMBL9063845 0.83 APP (0.69) MAOBPPARGHTR1AMET
Curcumin SCHEMBL27941763 0.83 TOP2A (0.64) MAOBHTR1ATOP2AMEN1TP53
SCHEMBL29670791 0.83 MAOB (0.74) MAOBTOP2AMEN1TP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8357353-B2 Compositions comprising a UV-absorbing chromophore BIOTECHNOLOGY RESEARCH & DEVELOPMENT CORPORATION (US) 2013-01-22 — — US disclosed
US-20100215600-A1 Compositions comprising a UV-absorbing chromophore BIOTECHNOLOGY RESEARCH & DEVELOPMENT CORPORATION (US) 2010-08-26 — — US disclosed
US-7727514-B2 Compositions comprising a UV-absorbing chromophore BIOTECHNOLOGY RESEARCH & DEVELOPMENT CORPORATION (US) 2010-06-01 — — US disclosed
US-7572610-B2 Methods of making compositions comprising a UV-Absorbing chromophore BIOTECHNOLOGY RESEARCH & DEVELOPMENT CORPORATION (US) 2009-08-11 — — US disclosed
US-20070077214-A1 COMPOSITIONS COMPRISING A UV-ABSORBING CHROMOPHORE BIOTECHNOLOGY RESEARCH & DEVELOPMENT CORPORATION (US) 2007-04-05 — — US disclosed
US-20070077636-A1 METHODS OF MAKING COMPOSITIONS COMPRISING A UV-ABSORBING CHROMOPHORE BIOTECHNOLOGY RESEARCH & DEVELOPMENT CORPORATION (US) 2007-04-05 — — 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 (2 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-20070077214-A1 COMPOSITIONS COMPRISING A UV-ABSORBING CHROMOPHORE CRY2, ERCC4, CCNB2 MAOB 162/4885PPARG 3605/4885HTR1A 3009/4885
US-20100215600-A1 Compositions comprising a UV-absorbing chromophore CRY2, ERCC4, CCNB2 MAOB 162/4885PPARG 3605/4885HTR1A 3009/4885

“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.

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