SCHEMBL1005864

SCHEMBL1005864

C=CCc1cc(CO)c(O)c(OC)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.61
TNKS2 Q9H2K2 1/20 0.61
ALDH1A1 P00352 4/20 0.55
CYP3A4 P08684 2/20 0.55
PTGS1 P23219 2/20 0.55
ALOX5 P09917 2/20 0.55
AR P10275 1/20 0.55
TRPM8 Q7Z2W7 1/20 0.55
PPARG P37231 1/20 0.51
PPARD Q03181 1/20 0.51
PPARA Q07869 1/20 0.51
CCR3 P51677 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
GABRA1 P14867 7/20 0.47
GABRB2 P47870 7/20 0.47
MEN1 O00255 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL6554990 0.90 TNKS (0.65) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL31255953 0.89 TNKS (0.63) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL13899835 0.89 TNKS (0.63) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL31510191 0.88 TNKS2 (0.58) TNKSTNKS2ALDH1A1CYP3A4PTGS1
Methoxyeugenol SCHEMBL293977 0.86 TNKS (0.73) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL15307678 0.84 ALDH1A1 (0.51) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL29554374 0.83 TNKS (0.61) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL417575 0.83 TNKS (0.57) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL18338811 0.83 TNKS (0.84) TNKSTNKS2ALDH1A1CYP3A4PTGS1
SCHEMBL30106410 0.83 TNKS (0.84) TNKSTNKS2ALDH1A1CYP3A4PTGS1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180093939-A9 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2018-04-05 US disclosed
US-20170233325-A1 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2017-08-17 US disclosed
EP-2451791-B1 UV/VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS NOVARTIS AG (CH) 2015-08-19 EP disclosed
US-8262947-B2 UV/visible light absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2012-09-11 US disclosed
US-8262947-B2 UV/visible light absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2012-09-11 US disclosed
US-8262947-B2 UV/visible light absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2012-09-11 US disclosed
EP-2451791-A1 UV/VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS Novartis AG (CH) 2012-05-16 EP disclosed
WO-2011137142-A1 INTRAOCULAR LENSES WITH COMBINATIONS OF UV ABSORBERS AND BLUE LIGHT CHROMOPHORES NOVARTIS AG (CH) 2011-11-03 WO disclosed
WO-2011005711-A1 UV/VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS ALCON, INC. (CH) 2011-01-13 WO disclosed
US-20110004301-A1 UV/VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS ALCON, INC. (CH) 2011-01-06 US disclosed
US-20030216493-A1 Latent mercaptans as multi-functional additives for halogen-containing polymer compositions PMC CINCINNATI, INC. 2003-11-20 US disclosed
US-6610218-B1 Substantially free of the offensive odor typical of mercaptans and which may be used as anti-oxidants, odorants, anti-microbial agents chelating agents and photostabilizers ROHM AND HAAS COMPANY 2003-08-26 US disclosed
US-6573318-B2 Highly effective heat stabilizers in halogenated polymer are prepared by the condensation of formaldehyde and para-substituted phenol and further condensation of the crude product with mercapto containing compound ROHM AND HAAS COMPANY 2003-06-03 US disclosed
US-6559214-B1 Composition comprising a halogen containing polymer and degradation products of a blocked mercaptan present as the sole heat stabilizer during processing of the composition at an elevated temperature, said products including a free PMC CINCINNATI, INC. 2003-05-06 US disclosed
US-6548707-B1 Deodorizing; heat and oxidation resistance; stabilizers ROHM AND HAAS COMPANY 2003-04-15 US disclosed
US-6537466-B1 Odor free heat stabilizers; also serve as intermediates for antioxidants, antimicrobial agents, photostabilizers, and primary heat stabilizers ROHM AND HAAS COMPANY 2003-03-25 US disclosed
US-20020068780-A1 LATENT MERCAPTANS AS MULTI-FUNCTIONAL ADDITIVES FOR HALOGEN-CONTAINING POLYMER COMPOSITIONS PMC CINCINNATI, INC. 2002-06-06 US disclosed
US-6326518-B1 HEAT STABILIZER MORTON INTERNATIONAL, INC. 2001-12-04 US disclosed
EP-0742259-B1 Latent mercaptans as multi-functional additives for halogen-containing polymer compositions MORTON INT INC (US) 2000-10-18 EP disclosed
EP-0742259-A1 Latent mercaptans as multi-functional additives for halogen-containing polymer compositions MORTON INTERNATIONAL, INC. (US) 1996-11-13 EP 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 (3 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-20110004301-A1 UV/VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS UACA, CRYZ, CRYAA TNKS 1009/4885TNKS2 1221/4885ALDH1A1 617/4885
US-20180093939-A9 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS TNKS 1149/4885TNKS2 950/4885ALDH1A1 2942/4885
US-20170233325-A1 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS TNKS 1149/4885TNKS2 950/4885ALDH1A1 2942/4885

“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.