SCHEMBL181588

SCHEMBL181588

O=C(O)C12CCCCC1(C(=O)O)O2

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.37
FFAR3 O14843 1/20 0.35
AKR1C1 Q04828 1/20 0.34
NPSR1 Q6W5P4 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
TSHR P16473 1/20 0.30
BLM P54132 1/20 0.30
CACNA2D1 P54289 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
SCHEMBL11418133 1.00 CYP2C19 (0.37) CYP2C19FFAR3AKR1C1NPSR1USP2
SCHEMBL10788998 0.82 CYP2C19 (0.37) CYP2C19FFAR3AKR1C1NPSR1USP2
SCHEMBL10520322 0.78 CYP2C19 (0.34) CYP2C19FFAR3AKR1C1
SCHEMBL19056401 0.78 FFAR3 (0.39) CYP2C19FFAR3NPSR1LMNABLM
SCHEMBL27450113 0.77 TSHR (0.39) ALDH1A1TSHRSMN1; SMN2
SCHEMBL28498843 0.73 CYP2C19 (0.32) CYP2C19FFAR3
SCHEMBL2772996 0.72 FFAR3 (0.32) CYP2C19FFAR3
SCHEMBL23245204 0.65 CYP2C19 (0.42) CYP2C19FFAR3AKR1C1NPSR1USP2
Hydrochloric Acid SCHEMBL4461485 0.65 CYP2C19 (0.42) CYP2C19FFAR3AKR1C1NPSR1USP2
SCHEMBL11208917 0.65 CYP2C19 (0.42) CYP2C19FFAR3AKR1C1NPSR1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3392036-B1 METHOD FOR PRODUCING LAMINATE, AND LAMINATE KANEKA CORP (JP) 2022-03-30 EP claimed
US-10836739-B2 Epoxycyclohexane dicarboxylic acid diester, plasticizer, stabilizer and resin composition NEW JAPAN CHEMICAL CO., LTD (JP) 2020-11-17 US claimed
EP-3392036-A1 METHOD FOR PRODUCING LAMINATE, AND LAMINATE Kaneka Corporation (JP) 2018-10-24 EP claimed
CN-108367547-A The manufacturing method and laminated body of laminated body 株式会社钟化 2018-08-03 CN claimed
US-20180127390-A1 EPOXYCYCLOHEXANE DICARBOXYLIC ACID DIESTER, PLASTICIZER, STABILIZER AND RESIN COMPOSITION NEW JAPAN CHEMICAL CO., LTD (JP) 2018-05-10 US claimed
US-9963601-B2 Photocationically curable ink jet ink, method of manufacturing photocationically curable ink jet ink, printed matter, and method of manufacturing printed matter TOKYO PRINTING INK MFG. CO., LTD. (JP) 2018-05-08 US claimed
EP-3305772-A1 EPOXYCYCLOHEXANE DICARBOXYLIC ACID DIESTER, PLASTICIZER, STABILIZER AND RESIN COMPOSITION New Japan Chemical Co., Ltd. (JP) 2018-04-11 EP claimed
US-20160257828-A1 PHOTOCATIONICALLY CURABLE INK JET INK, METHOD OF MANUFACTURING PHOTOCATIONICALLY CURABLE INK JET INK, PRINTED MATTER, AND METHOD OF MANUFACTURING PRINTED MATTER TOKYO PRINTING INK MFG. CO., LTD. (JP) 2016-09-08 US claimed
EP-3056551-A1 PHOTOCATIONIC CURABLE INKJET INK, PRODUCTION METHOD FOR PHOTOCATIONIC CURABLE INKJET INK, PRINTED ARTICLE, AND PRODUCTION METHOD FOR PRINTED ARTICLE Tokyo Printing Ink Mfg. Co. Ltd. (JP) 2016-08-17 EP claimed
JP-61004748-A None JP disclosed
JP-58222136-A None JP disclosed
JP-59113014-A None JP disclosed
US-12043775-B2 Adhesive film RIKEN TECHNOS CORPORATION (JP) 2024-07-23 US disclosed
CN-118325041-A Curable composition, method for producing cured product, and cured product thereof 株式会社ADEKA 2024-07-12 CN disclosed
EP-0189899-A2 Synthetic resin composition having reduced corrosion-causing tendency and coloration Kyowa Chemical Industry Co., Ltd. (JP) 1986-08-06 EP disclosed
JP-S614748-A VINYL CHLORIDE RESIN COMPOSITION TERUMO CORP 1986-01-10 JP disclosed
JP-S59113014-A MOLD RELEASABLE RESIN AND MOLD RELEASABLE RESIN COMPOSITION SUMITOMO BAKELITE CO LTD 1984-06-29 JP disclosed
JP-S58222136-A COMPOSITION OF VINYL CHLORIDE RESIN HAVING HIGH DEGREE OF POLYMERIZATION NEW JAPAN CHEM CO LTD 1983-12-23 JP disclosed
US-4288488-A Laminated packing material with a high gas-impermeablility and an advantageous workability KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1981-09-08 US disclosed
US-4117029-A VINYL CHLORIDE POLYE NITTO KASEI CO. LTD. (JP) 1978-09-26 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 (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-10836739-B2 Epoxycyclohexane dicarboxylic acid diester, plasticizer, stabilizer and resin composition CECR2, DCLRE1A, DDT CYP2C19 2754/4885FFAR3 1413/4885AKR1C1 822/4885
US-20180127390-A1 EPOXYCYCLOHEXANE DICARBOXYLIC ACID DIESTER, PLASTICIZER, STABILIZER AND RESIN COMPOSITION CECR2, DCLRE1A, DDT CYP2C19 2754/4885FFAR3 1413/4885AKR1C1 822/4885

“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.