SCHEMBL12430835

SCHEMBL12430835

C=C(C)C(=O)OC(C(O)CO)C(OC(=O)C(=C)C)C(O)CO

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.39
THRB P10828 1/20 0.34
TGFBR1 P36897 1/20 0.33
PDE4A P27815 1/20 0.30

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
SCHEMBL2032167 1.00 TSHR (0.41) TSHRALDH1A1THRBTGFBR1PDE4A
SCHEMBL3798205 0.96 TSHR (0.41) TSHRALDH1A1THRBTGFBR1PDE4A
SCHEMBL12585313 0.93 TSHR (0.36) TSHRALDH1A1THRBTGFBR1
SCHEMBL6014081 0.92 TSHR (0.42) TSHRALDH1A1THRBTGFBR1
SCHEMBL2489434 0.87 TSHR (0.33) TSHRALDH1A1
SCHEMBL2491057 0.87 TSHR (0.33) TSHRALDH1A1
SCHEMBL2489327 0.87 TSHR (0.33) TSHRALDH1A1
SCHEMBL14816371 0.85 TSHR (0.46) TSHRALDH1A1THRB
SCHEMBL60549 0.85 TSHR (0.46) TSHRALDH1A1THRB
SCHEMBL13670752 0.84 TSHR (0.33) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2301975-B1 POLYMERIZABLE COMPOSITION SUITABLE FOR LED LIGHT SOURCE KURARAY NORITAKE DENTAL INC (JP) 2013-07-24 EP disclosed
US-7977405-B2 Polymerizable monomer-containing composition Kurray Medical Inc. (JP) 2011-07-12 US disclosed
US-7977405-B2 Polymerizable monomer-containing composition Kurray Medical Inc. (JP) 2011-07-12 US disclosed
US-7968615-B2 Polymerizable monomer, polymerizable composition and dental material KURARAY MEDICAL INC. (JP) 2011-06-28 US disclosed
US-7968615-B2 Polymerizable monomer, polymerizable composition and dental material KURARAY MEDICAL INC. (JP) 2011-06-28 US disclosed
US-20110124763-A1 POLYMERIZABLE COMPOSITION SUITABLE FOR LED LIGHT SOURCE KURARAY MEDICAL INC. (JP) 2011-05-26 US disclosed
US-20110124763-A1 POLYMERIZABLE COMPOSITION SUITABLE FOR LED LIGHT SOURCE KURARAY MEDICAL INC. (JP) 2011-05-26 US disclosed
EP-2301975-A1 POLYMERIZABLE COMPOSITION SUITABLE FOR LED LIGHT SOURCE Kuraray Medical Inc. (JP) 2011-03-30 EP disclosed
US-20100130682-A1 POLYMERIZABLE MONOMER, POLYMERIZABLE COMPOSITION, AND DENTAL MATERIAL KURARAY MEDICAL INC. (JP) 2010-05-27 US disclosed
US-20100130682-A1 POLYMERIZABLE MONOMER, POLYMERIZABLE COMPOSITION, AND DENTAL MATERIAL KURARAY MEDICAL INC. (JP) 2010-05-27 US disclosed
US-20100048762-A1 COMPOSITION AND DENTAL MATERIAL KURARAY MEDICAL INC. (JP) 2010-02-25 US disclosed
US-20100048762-A1 COMPOSITION AND DENTAL MATERIAL KURARAY MEDICAL INC. (JP) 2010-02-25 US disclosed
US-20100048761-A1 POLYMERIZABLE MONOMER-CONTAINING COMPOSITION KURARAY MEDICAL INC. (JP) 2010-02-25 US disclosed
US-20100036075-A1 POLYMERIZABLE MONOMER-CONTAINING COMPOSITION KURARAY MEDICAL INC. (JP) 2010-02-11 US disclosed
US-20100036075-A1 POLYMERIZABLE MONOMER-CONTAINING COMPOSITION KURARAY MEDICAL INC. (JP) 2010-02-11 US disclosed
WO-2010008077-A1 POLYMERIZABLE COMPOSITION SUITABLE FOR LED LIGHT SOURCE クラレメディカル株式会社 (JP) 2010-01-21 WO disclosed
EP-2133368-A1 POLYMERIZABLE MONOMER, POLYMERIZABLE COMPOSITION AND DENTAL MATERIAL Kuraray Medical Inc. (JP) 2009-12-16 EP disclosed
EP-2112177-A1 POLYMERIZABLE MONOMER-CONTAINING COMPOSITION Kuraray Medical Inc. (JP) 2009-10-28 EP disclosed
EP-2108663-A1 POLYMERIZABLE MONOMER, POLYMERIZABLE COMPOSITION AND DENTAL MATERIAL Kuraray Medical Inc. (JP) 2009-10-14 EP disclosed
EP-2108664-A1 COMPOSITION AND DENTAL MATERIAL Kuraray Medical Inc. (JP) 2009-10-14 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-20100048761-A1 POLYMERIZABLE MONOMER-CONTAINING COMPOSITION WDR82, PWWP2B, WDR5 TSHR 4883/4885ALDH1A1 2410/4885THRB 4280/4885
US-20100048762-A1 COMPOSITION AND DENTAL MATERIAL PHOSPHO1, PDS5B, ITGB5 TSHR 4802/4885ALDH1A1 717/4885THRB 2986/4885
US-20100130682-A1 POLYMERIZABLE MONOMER, POLYMERIZABLE COMPOSITION, AND DENTAL MATERIAL SMCHD1, MLEC, PGA5 TSHR 4786/4885ALDH1A1 3709/4885THRB 4316/4885

“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.