SCHEMBL15323

SCHEMBL15323

CCN(CC)C(=S)N(CC)CC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.56
CA1 P00915 5/20 0.56
CA2 P00918 5/20 0.56
CA9 Q16790 5/20 0.56
EHMT2 Q96KQ7 3/20 0.56
EHMT1 Q9H9B1 3/20 0.56
ABCB11 O95342 2/20 0.56
HTT P42858 2/20 0.56
GSDMD P57764 2/20 0.56
CA4 P22748 2/20 0.56
CYP2E1 P05181 1/20 0.56
PTGS1 P23219 1/20 0.56
ALDH1A1 P00352 7/20 0.53
MGLL Q99685 5/20 0.53
ALDH2 P05091 4/20 0.53
PHGDH O43175 3/20 0.53
CYP3A4 P08684 2/20 0.53
LMNA P02545 2/20 0.53
CYP2C9 P11712 2/20 0.53
HPGD P15428 2/20 0.53

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
SCHEMBL9665272 0.83 TAS2R38 (0.53) CA12CA1CA2CA9EHMT2
SCHEMBL9665479 0.81 CA12 (0.46) CA12CA1CA2CA9EHMT2
SCHEMBL11866934 0.81 CA12 (0.57) CA12CA1CA2CA9EHMT2
SCHEMBL431669 0.78 CA12 (0.43) CA12CA1CA2CA9EHMT2
SCHEMBL8719555 0.77 CA12 (0.56) CA12CA1CA2CA9EHMT2
SCHEMBL7547953 0.74 ALDH1A1 (0.45) CA12CA1CA2CA9EHMT2
SCHEMBL9453353 0.74
SCHEMBL611243 0.74
SCHEMBL689792 0.74
SCHEMBL23892055 0.74

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 1280 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118439936-A Method for preparing anisic aldehyde by using p-methoxybenzyl chloride 山东新和成药业有限公司 2024-08-06 CN claimed
CN-118440104-A Boron-containing%10B) Preparation method of medicine BSH and intermediate thereof 安徽普利药业有限公司 2024-08-06 CN claimed
CN-117064765-B Dental adhesive restorative material composition and application thereof 长春新斯达科技有限公司 2023-12-29 CN claimed
CN-115105416-B Acrylic ester composite resin composition and preparation method and application thereof 爱迪特(秦皇岛)科技股份有限公司 2023-11-21 CN claimed
CN-117064765-A Dental adhesive restorative material composition and application thereof 长春新斯达科技有限公司 2023-11-17 CN claimed
CN-115427475-A Oxidizable-reducing curing composition and preparation method thereof 汉高股份有限及两合公司 2022-12-02 CN claimed
CN-115105416-A Acrylate composite resin composition and preparation method and application thereof 爱迪特(秦皇岛)科技股份有限公司 2022-09-27 CN claimed
US-10025005-B2 Composition for optical materials MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2018-07-17 US claimed
US-9793566-B2 Aqueous electrolytes for redox flow battery systems BATTELLE MEMORIAL INSTITUTE (US) 2017-10-17 US claimed
US-20160308233-A1 AQUEOUS ELECTROLYTES FOR REDOX FLOW BATTERY SYSTEMS BATTELLE MEMORIAL INSTITUTE (US) 2016-10-20 US claimed
EP-1716197-B1 HIGHLY FUNCTIONAL, HIGHLY BRANCHED POLYUREAS BASF SE (DE) 2008-10-29 EP claimed
US-7153411-B2 Method for cleaning and polishing metallic alloys and articles cleaned or polished thereby BOSTON SCIENTIFIC SCIMED, INC. (US) 2006-12-26 US claimed
US-6982288-B2 Dental cements, filling materials, adhesives 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-01-03 US claimed
JP-2005524682-A 2005-08-18 JP claimed
EP-1496837-A1 MEDICAL COMPOSITIONS CONTAINING AN IONIC SALT 3M Innovative Properties Company (US) 2005-01-19 EP claimed
WO-2003086328-A1 MEDICAL COMPOSITIONS CONTAINING AN IONIC SALT 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-10-23 WO claimed
US-20030195273-A1 Medical compositions containing an ionic salt, kits, and methods 3M INNOVATIVE PROPERTIES COMPANY 2003-10-16 US claimed
US-5147905-A Cationic polyepoxide and epoxy resins for electrodeposition; flexibility; workability THE DOW CHEMICAL COMPANY (US) 1992-09-15 US claimed
EP-0483352-A1 ADVANCED AND UNADVANCED EPOXY RESIN COMPOSITIONS, NUCLEOPHILIC DERIVATIVES THEREOF AND CURABLE AND COATING COMPOSITIONS THEREOF THE DOW CHEMICAL COMPANY (US) 1992-05-06 EP claimed
WO-1991018034-A1 ADVANCED AND UNADVANCED COMPOSITIONS, NUCLEOPHILIC DERIVATIVES THEREOF AND CURABLE AND COATING COMPOSITIONS THEREOF THE DOW CHEMICAL COMPANY (US) 1991-11-28 WO claimed

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-10025005-B2 Composition for optical materials CRYZ, CRYAA, CRYAB CA12 1953/4885CA1 1773/4885CA2 1192/4885
US-20030195273-A1 Medical compositions containing an ionic salt, kits, and methods NOX4, SCN4A, IL4 CA12 158/4885CA1 96/4885CA2 34/4885

“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.