SCHEMBL1974751

SCHEMBL1974751

C=C(C)C(=O)OC(=O)C(=C)C.C=C(C)C(=O)OCC(CC)(CO)COC(=O)C(=C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.41
TSHR P16473 3/20 0.40
ALDH1A1 P00352 3/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL443709 0.95 THRB (0.44) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL2511404 0.93 THRB (0.43) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL30451 0.91 THRB (0.44) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL2764467 0.91 THRB (0.44) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL28215329 0.91 THRB (0.44) THRBTSHRALDH1A1
SCHEMBL2637971 0.89 THRB (0.43) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL5446418 0.89 THRB (0.43) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL5264945 0.89 THRB (0.43) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL3756979 0.89 THRB (0.43) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL18045660 0.88 THRB (0.43) THRBTSHRALDH1A1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6676795-B1 CURING MIXTURE CONTAINING (METH)ACRYLATE CAPPED POLYURETHANE, (METH)ACRYLATE DILUENT MONOMER, ANAEROBIC CURING SYSTEM AND FREE-RADICAL PHOTOINITIATOR HENKEL LOCTITE CORPORATION 2004-01-13 US claimed
US-8445615-B2 Two-component adhesive suitable for construction purposes, its use and the cured structural bonds obtained thereby HILTI AKTIENGESELLSCHAFT (LI) 2013-05-21 US disclosed
US-20130085186-A1 COSMETIC PREPARATIONS BASED ON MOLECULARLY IMPRINTED POLYMERS BASF SE (DE) 2013-04-04 US disclosed
EP-2336214-B1 A two-component adhesive suitable for construction purposes, its use and the cured structural bonds obtained thereby HILTI AG (LI) 2012-05-02 EP disclosed
EP-2336214-A1 A two-component adhesive suitable for construction purposes, its use and the cured structural bonds obtained thereby HILTI Aktiengesellschaft (LI) 2011-06-22 EP disclosed
US-20110143061-A1 TWO-COMPONENT ADHESIVE SUITABLE FOR CONSTRUCTION PURPOSES, ITS USE AND THE CURED STRUCTURAL BONDS OBTAINED THEREBY HILTI AKTIENGESELLSCHAFT (LI) 2011-06-16 US disclosed
US-6676795-B1 CURING MIXTURE CONTAINING (METH)ACRYLATE CAPPED POLYURETHANE, (METH)ACRYLATE DILUENT MONOMER, ANAEROBIC CURING SYSTEM AND FREE-RADICAL PHOTOINITIATOR HENKEL LOCTITE CORPORATION 2004-01-13 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-20130085186-A1 COSMETIC PREPARATIONS BASED ON MOLECULARLY IMPRINTED POLYMERS PRDM7, FABP4, PLIN1 THRB 4662/4885TSHR 4219/4885ALDH1A1 166/4885

“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.