SCHEMBL2046579

SCHEMBL2046579

CC(C)(C)Oc1cccc([O])c1OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.38
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL2220781 0.84 KCNH2 (0.43) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL843830 0.82 KCNH2 (0.38) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL9647568 0.78 KCNH2 (0.42) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL6783300 0.78 CA2 (0.40) ALDH1A1
SCHEMBL19910013 0.78 KCNH2 (0.37) KCNH2
SCHEMBL4004810 0.77 KCNH2 (0.39) KCNH2
SCHEMBL3789902 0.77 L3MBTL1 (0.39) KCNH2KDM4E
SCHEMBL2908824 0.75 ALDH1A1 (0.43) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL28449193 0.75 KCNH2 (0.38) KCNH2
SCHEMBL2094184 0.75 KDM4E (0.38) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165443-A1 THERMOPLASTIC RESINS CONTAINING PBT UNITS, HAVING REDUCED ORGANIC CARBON EMISSIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-28 US claimed
US-8148489-B2 Thermoplastic resins containing PBT units, having reduced organic carbon emissions E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-04-03 US claimed
US-20070225475-A1 Thermoplastic resins containing PBT units, having reduced organic carbon emissions DUPONT POLYMERS, INC. 2007-09-27 US claimed
US-20120165443-A1 THERMOPLASTIC RESINS CONTAINING PBT UNITS, HAVING REDUCED ORGANIC CARBON EMISSIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-28 US disclosed
US-8148489-B2 Thermoplastic resins containing PBT units, having reduced organic carbon emissions E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-04-03 US disclosed
US-20110210322-A1 POLYMER COMPOUND CONTAINING NITROGEN-CONTAINING HETEROCYCLIC STRUCTURE, AND COMPOSITION, SOLUTION, THIN FILM AND POLYMER LIGHT-EMITTING ELEMENT EACH CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-01 US disclosed
EP-2336215-A1 POLYMER COMPOUND CONTAINING NITROGEN-CONTAINING HETEROCYCLIC STRUCTURE, AND COMPOSITION, SOLUTION, THIN FILM AND POLYMER LIGHT-EMITTING ELEMENT EACH CONTAINING SAME Sumitomo Chemical Company, Limited (JP) 2011-06-22 EP disclosed
US-20070225475-A1 Thermoplastic resins containing PBT units, having reduced organic carbon emissions DUPONT POLYMERS, INC. 2007-09-27 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-20110210322-A1 POLYMER COMPOUND CONTAINING NITROGEN-CONTAINING HETEROCYCLIC STRUCTURE, AND COMPOSITION, SOLUTION, THIN FILM AND POLYMER LIGHT-EMITTING ELEMENT EACH CONTAINING SAME H1-10, RNF10, F10 KCNH2 1670/4885KDM4E 1924/4885ALDH1A1 2963/4885

“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.