SCHEMBL1304140

SCHEMBL1304140

C=C(C)C(=O)OCCCCCCN=C=O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.59
POLB P06746 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
THRB P10828 1/20 0.43
ALDH1A1 P00352 3/20 0.34
CYP3A4 P08684 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
NAAA Q02083 1/20 0.31
RAD52 P43351 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL2481162 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL2480778 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1527497 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL17780845 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL181712 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1850039 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL5362558 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL2483259 1.00 TSHR (0.59) TSHRPOLBAPEX1HTTTDP1
SCHEMBL633702 0.98 TSHR (0.56) TSHRPOLBAPEX1HTTTDP1
SCHEMBL181751 0.93 TSHR (0.53) TSHRPOLBAPEX1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2558441-B1 PROCESS FOR PRODUCING ISOCYANATES 3M INNOVATIVE PROPERTIES CO (US) 2018-05-30 EP claimed
US-9006480-B2 Process for producing isocyanates 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-04-14 US claimed
EP-2558441-A1 PROCESS FOR PRODUCING ISOCYANATES 3M Innovative Properties Company (US) 2013-02-20 EP claimed
US-20130023694-A1 PROCESS FOR PRODUCING ISOCYANATES 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-01-24 US claimed
US-20120205234-A1 POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION SHOWA DENKO K.K. (JP) 2012-08-16 US claimed
WO-2011130032-A1 PROCESS FOR PRODUCING ISOCYANATES 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-10-20 WO claimed
EP-2377847-A1 Process for producing isocyanates 3M Innovative Properties Company (US) 2011-10-19 EP claimed
US-20100099827-A1 POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION SHOWA DENKO K.K. (JP) 2010-04-22 US claimed
EP-2091994-A1 POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION Showa Denko K.K. (JP) 2009-08-26 EP claimed
WO-2008069256-A1 POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION SHOWA DENKO K.K. (JP) 2008-06-12 WO claimed
US-5213934-A Core of colorant and binder grafted to polymeric shell XEROX CORPORATION (US) 1993-05-25 US claimed
CN-122055350-A Method for producing monomer precursor composition 东丽株式会社 2026-05-15 CN disclosed
WO-2025084057-A1 METHOD FOR PRODUCING MONOMER PRECURSOR COMPOSITION 東レ株式会社 2025-04-24 WO disclosed
US-12180136-B2 Organic amine collection method ASAHI KASEL KABUSHIKI KAISHA (JP) 2024-12-31 US disclosed
US-20240425448-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUND, METHOD FOR PRODUCING CARBAMATE COMPOUND, METHOD FOR RECOVERING AMINE COMPOUND, AND ISOCYANATE COMPOSITION ASAHI KASEI KABUSHIKI KAISHA (JP) 2024-12-26 US disclosed
US-4436885-A Preparation of isocyanate-functional polymers containing a terminal monosulfide group E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-03-13 US disclosed
US-4351755-A MOISTURE CURABLE COATINGS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-09-28 US disclosed
US-4273690-A Coating compositions of an alkyd-acrylic graft copolymer E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-06-16 US disclosed
US-4222909-A Coating compositions comprising isocyanate-functional polymers containing a terminal thioalkyl group E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-09-16 US disclosed
US-RE29772-E IMPACT STRENGTH, CLARITY, WEATHER RESISTANCE ROHM AND HAAS COMPANY (US) 1978-09-19 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 (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-12180136-B2 Organic amine collection method H1-0, F12, C1S TSHR 1695/4885POLB 95/4885APEX1 920/4885
US-20130023694-A1 PROCESS FOR PRODUCING ISOCYANATES IDH2, IDH1, IDH3A TSHR 4866/4885POLB 2495/4885APEX1 1216/4885
US-20240425448-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUND, METHOD FOR PRODUCING CARBAMATE COMPOUND, METHOD FOR RECOVERING AMINE COMPOUND, AND ISOCYANATE COMPOSITION IDH3A, CA7, C9 TSHR 4594/4885POLB 1301/4885APEX1 730/4885

“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.