SCHEMBL4452364

SCHEMBL4452364

CCC(CC)OCC(C)O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
TDP1 Q9NUW8 2/20 0.46
HSD17B10 Q99714 1/20 0.44
MAPK1 P28482 1/20 0.40
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL16933768 0.91 TDP1 (0.55) TSHRTDP1HSD17B10MAPK1
SCHEMBL7533605 0.87 TDP1 (0.42) TSHRTDP1HSD17B10MAPK1LMNA
SCHEMBL15831105 0.85 HSD17B10 (0.48) TSHRTDP1HSD17B10MAPK1MAPT
SCHEMBL16933843 0.85 TDP1 (0.45) TSHRTDP1HSD17B10MAPK1LMNA
SCHEMBL15049102 0.82 TDP1 (0.42) TSHRTDP1HSD17B10MAPK1MAPT
SCHEMBL8520740 0.80 MAPT (0.42) TSHRTDP1HSD17B10LMNAMAPT
SCHEMBL1835824 0.80 TSHR (0.36) TSHR
SCHEMBL4511080 0.79 MAPT (0.44) TDP1HSD17B10LMNAMAPT
SCHEMBL16933815 0.79 TDP1 (0.53) TSHRTDP1HSD17B10MAPK1MAPT
SCHEMBL1476173 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3536683-B1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION ASAHI CHEMICAL IND (JP) 2021-11-24 EP disclosed
EP-3372579-B1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION ASAHI CHEMICAL IND (JP) 2020-10-28 EP disclosed
CN-107614596-B Olefin resin composition, film, and medical container 住友化学株式会社 2020-08-28 CN disclosed
EP-3536683-A1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2019-09-11 EP disclosed
CN-105254843-B Polyisocyantates composition, blocked polyisocyanates composition and their manufacturing method 旭化成株式会社 2019-08-06 CN disclosed
US-10301417-B2 Polyisocyanate composition and isocyanate polymer composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2019-05-28 US disclosed
US-10125212-B2 Polyisocyanate composition and isocyanate polymer composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-11-13 US disclosed
CN-106008269-B Polyisocyantates composition and isocyanate polymer composition 旭化成株式会社 2018-10-19 CN disclosed
EP-3372579-A1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2018-09-12 EP disclosed
US-20170298169-A1 Polyisocyanate Composition and Isocyanate Polymer Composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2017-10-19 US disclosed
EP-2915803-A1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION Asahi Kasei Chemicals Corporation (JP) 2015-09-09 EP disclosed
US-20150210631-A1 Polyisocyanate Composition and Isocyanate Polymer Composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-07-30 US disclosed
CN-104619682-A Polyisocyanate composition and isocyanate polymer composition ASAHI KASEI CHEMICALS CORP 2015-05-13 CN disclosed
EP-1958980-B1 THERMOPLASTIC ELASTOMER COMPOSITION, FOAM PRODUCT, AND PROCESS FOR PRODUCTION OF THE COMPOSITION OR FOAM PRODUCT JSR CORP (JP) 2012-10-31 EP disclosed
US-20090270525-A1 THERMOPLASTIC ELASTOMER COMPOSITION, FOAM PRODUCT, AND PROCESS FOR PRODUCTION OF THE COMPOSITION OR FOAM PRODUCT JSR CORPORATION (JP) 2009-10-29 US disclosed
EP-1958980-A1 THERMOPLASTIC ELASTOMER COMPOSITION, FOAM PRODUCT, AND PROCESS FOR PRODUCTION OF THE COMPOSITION OR FOAM PRODUCT JSR Corporation (JP) 2008-08-20 EP disclosed
EP-1148097-B1 Thermoplastic resin composition JSR CORP (JP) 2006-02-01 EP disclosed
US-6548598-B2 Blend consists of a polyphenylene ether, a polyolefin resin, a hydrogenated block copolymer of vinyl aromatic monomer and a conjugated diene monomer; exhibit excellent heat resistance and impact strength, rigidity and tensile breaking elongation JSR CORPORATION (JP) 2003-04-15 US disclosed
US-20010047055-A1 Blend consists of a polyphenylene ether, a polyolefin resin, a hydrogenated block copolymer of vinyl aromatic monomer and a conjugated diene monomer; exhibit excellent heat resistance and impact strength, rigidity and tensile breaking elongation JSR CORPORATION (JP) 2001-11-29 US disclosed
EP-1148097-A1 Thermoplastic resin composition JSR Corporation (JP) 2001-10-24 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 (4 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-10301417-B2 Polyisocyanate composition and isocyanate polymer composition PAH, ALKBH1, ALKBH3 TSHR 4682/4885TDP1 621/4885HSD17B10 474/4885
US-20170298169-A1 Polyisocyanate Composition and Isocyanate Polymer Composition TST, SUDS3, SCLY TSHR 4448/4885TDP1 4009/4885HSD17B10 592/4885
US-10125212-B2 Polyisocyanate composition and isocyanate polymer composition TST, SUDS3, SCLY TSHR 4448/4885TDP1 4009/4885HSD17B10 592/4885
US-20150210631-A1 Polyisocyanate Composition and Isocyanate Polymer Composition TST, SUDS3, SCLY TSHR 4448/4885TDP1 4009/4885HSD17B10 592/4885

“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.