SCHEMBL473672

SCHEMBL473672

O=C(CCS)OC1CCC1OC(=O)CCS

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.33
ACE P12821 3/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL15796781 0.91 NAAA (0.39) NAAA
SCHEMBL331525 0.81 NAAA (0.46) NAAASMN1; SMN2
SCHEMBL593981 0.81
SCHEMBL938890 0.80 TSHR (0.42) CHRM2CHRM4CHRM1CHRM3
SCHEMBL15019047 0.77 BCHE (0.45)
SCHEMBL5829801 0.76 NAAA (0.58) NAAASMN1; SMN2
SCHEMBL28080766 0.74 NAAA (0.41) NAAASMN1; SMN2
SCHEMBL25475215 0.73 NAAA (0.40) NAAACHRM3SMN1; SMN2
SCHEMBL24388697 0.72 BCHE (0.32)
SCHEMBL24388667 0.72

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
EP-2571914-B1 A POLYMERIZATION CATALYST FOR POLYTHIOURETHANES, POLYMERIZABLE LIQUID COMPOSITION AND PROCESS FOR THE PRODUCTION OF ORGANIC POLYTHIOURETHANE GLASS WITH A HIGH REFRACTIVE INDEX MITSUI CHEMICALS INC (JP) 2021-12-29 EP claimed
EP-4674881-A2 XYLYLENE DIISOCYANATE COMPOSITION, POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, RESIN, MOLDED BODY, OPTICAL ELEMENT AND LENS Mitsui Chemicals, Inc. (JP) 2026-01-07 EP disclosed
EP-4151623-B1 XYLYLENE DIISOCYANATE COMPOSITION, POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, RESIN, MOLDED BODY, OPTICAL ELEMENT AND LENS MITSUI CHEMICALS INC (JP) 2025-11-26 EP disclosed
US-20240294695-A1 POLYISOCYANATE COMPOSITION, POLYMERIZABLE COMPOSITION, RESIN, MOLDED ARTICLE, OPTICAL ELEMENT, AND LENS MITSUI CHEMICALS, INC. (JP) 2024-09-05 US disclosed
EP-4414774-A2 XYLYLENE DIISOCYANATE COMPOSITION, XYLYLENE DIISOCYANATE MODIFIED COMPOSITION, POLYMERIZABLE COMPOSITION, RESIN, MOLDED ARTICLE, OPTICAL ELEMENT, AND LENS Mitsui Chemicals, Inc. (JP) 2024-08-14 EP disclosed
EP-4089071-B1 XYLYLENE DIISOCYANATE COMPOSITION, MODIFIED XYLYLENE DIISOCYANATE COMPOSITION, POLYMERIZABLE COMPOSITION, RESIN, MOLDED BODY, OPTICAL ELEMENT, AND LENS MITSUI CHEMICALS INC (JP) 2024-08-07 EP disclosed
EP-4361191-A1 POLYISOCYANATE COMPOSITION, POLYMERIZABLE COMPOSITION, RESIN, MOLDED BODY, OPTICAL ELEMENT, AND LENS MITSUI CHEMICALS, INC. (JP) 2024-05-01 EP disclosed
US-20230340183-A1 XYLYLENE DIISOCYANATE COMPOSITION, XYLYLENE DIISOCYANATE MODIFIED COMPOSITION, POLYMERIZABLE COMPOSITION, RESIN, MOLDED ARTICLE, OPTICAL ELEMENT, AND LENS MITSUI CHEMICALS, INC. (JP) 2023-10-26 US disclosed
US-11753367-B2 Xylylene diisocyanate composition, polymerizable composition for optical material, resin, molded article, optical element, and lens MITSUI CHEMICALS, INC. (JP) 2023-09-12 US disclosed
US-20230202971-A1 XYLYLENE DIISOCYANATE COMPOSITION, POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, RESIN, MOLDED ARTICLE, OPTICAL ELEMENT, AND LENS MITSUI CHEMICALS, INC. (JP) 2023-06-29 US disclosed
US-20160238857-A1 EYEWEAR MATERIAL, EYEWEAR FRAME, AND EYEWEAR MITSUI CHEMICALS, INC. (JP) 2016-08-18 US disclosed
EP-3051331-A1 EYEWEAR MATERIAL, EYEWEAR FRAME AND EYEWEAR Mitsui Chemicals, Inc. (JP) 2016-08-03 EP disclosed
EP-1511025-B1 OPTICAL INFORMATION MEDIUM AND PRODUCTION METHOD THEREFOR TDK CORP (JP) 2012-02-01 EP disclosed
EP-1862855-B1 PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES (JP) 2011-10-05 EP disclosed
US-7838097-B2 Hardcoat agent composition and optical information medium thereof TDK CORPORATION (JP) 2010-11-23 US disclosed
US-20100040823-A1 HARDCOAT AGENT COMPOSITION AND OPTICAL INFORMATION MEDIUM THEREOF TDK CORPORATION (JP) 2010-02-18 US disclosed
US-7632874-B2 Hardcoat agent composition and optical information medium thereof TDK CORPORATION (JP) 2009-12-15 US disclosed
US-20070148596-A1 Hardcoat agent composition and optical information medium thereof TDK CORPORATION (JP) 2007-06-28 US disclosed
US-5229243-A Addition polymer core, polyurethane or polythiourethane shell KAO CORPORATION (JP) 1993-07-20 US disclosed
EP-0501673-A1 Encapsulated toner for heat pressure fixing Kao Corporation (JP) 1992-09-02 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 (2 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-11753367-B2 Xylylene diisocyanate composition, polymerizable composition for optical material, resin, molded article, optical element, and lens DCXR, CRYAA, CDYL NAAA 2138/4885ACE 3331/4885CHRM2 3440/4885
US-20230202971-A1 XYLYLENE DIISOCYANATE COMPOSITION, POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, RESIN, MOLDED ARTICLE, OPTICAL ELEMENT, AND LENS DCXR, CRYAA, CDYL NAAA 2138/4885ACE 3331/4885CHRM2 3440/4885

“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.