SCHEMBL4113305

SCHEMBL4113305

COC(=O)CCCCCCCCCS

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.64
LMNA P02545 2/20 0.55
ALDH1A1 P00352 1/20 0.55
HSD17B10 Q99714 1/20 0.50
FOLH1 Q04609 1/20 0.48
KMT2A Q03164 2/20 0.46
RECQL P46063 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
EPHX2 P34913 3/20 0.42
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
POLA1 P09884 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL18966483 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL2597017 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL4283433 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL11525673 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL8429080 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL5829754 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL8726527 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL8987158 1.00 TSHR (0.64) TSHRLMNAALDH1A1HSD17B10FOLH1
SCHEMBL2855754 0.98
SCHEMBL305297 0.90

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109071714-B Process for producing vinyl chloride-based polymer 株式会社LG化学 2021-03-09 CN claimed
US-10766976-B2 Method of preparing vinyl chloride-based polymer LG CHEM, LTD. (KR) 2020-09-08 US claimed
EP-3404048-B1 METHOD FOR PREPARING VINYL CHLORIDE BASED POLYMER LG CHEMICAL LTD (KR) 2020-08-26 EP claimed
EP-2956487-B1 USE OF METHYL MERCAPTO-ESTERS AS CHAIN TRANSFER AGENTS ARKEMA FRANCE (FR) 2019-04-24 EP claimed
US-20190048110-A1 METHOD OF PREPARING VINYL CHLORIDE-BASED POLYMER LG CHEM, LTD. (KR) 2019-02-14 US claimed
EP-3404048-A1 METHOD FOR PREPARING VINYL CHLORIDE BASED POLYMER LG Chem, Ltd. (KR) 2018-11-21 EP claimed
US-9126919-B2 Use of mercapto-methyl esters as chain transfer agents ARKEMA FRANCE (FR) 2015-09-08 US claimed
US-20140235807-A1 Use of Mercapto-Methyl Esters as Chain Transfer Agents ARKEMA FRANCE (FR) 2014-08-21 US claimed
CN-109071714-B Process for producing vinyl chloride-based polymer 株式会社LG化学 2021-03-09 CN disclosed
US-10766976-B2 Method of preparing vinyl chloride-based polymer LG CHEM, LTD. (KR) 2020-09-08 US disclosed
EP-3404048-B1 METHOD FOR PREPARING VINYL CHLORIDE BASED POLYMER LG CHEMICAL LTD (KR) 2020-08-26 EP disclosed
US-20190048110-A1 METHOD OF PREPARING VINYL CHLORIDE-BASED POLYMER LG CHEM, LTD. (KR) 2019-02-14 US disclosed
EP-3404048-A1 METHOD FOR PREPARING VINYL CHLORIDE BASED POLYMER LG Chem, Ltd. (KR) 2018-11-21 EP disclosed
US-20170008840-A1 SULFUR-CONTAINING PHENOL DERIVATIVES ARKEMA FRANCE (FR) 2017-01-12 US disclosed
US-8076299-B2 Method for producing peptide thioester RIKEN (JP) 2011-12-13 US disclosed
US-8076299-B2 Method for producing peptide thioester RIKEN (JP) 2011-12-13 US disclosed
US-8076299-B2 Method for producing peptide thioester RIKEN (JP) 2011-12-13 US disclosed
US-20090240034-A1 METHOD FOR PRODUCING PEPTIDE THIOESTER RIKEN (JP) 2009-09-24 US disclosed
US-20090240034-A1 METHOD FOR PRODUCING PEPTIDE THIOESTER RIKEN (JP) 2009-09-24 US disclosed
US-20090240034-A1 METHOD FOR PRODUCING PEPTIDE THIOESTER RIKEN (JP) 2009-09-24 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-20170008840-A1 SULFUR-CONTAINING PHENOL DERIVATIVES HSF1, TYR, SQOR TSHR 3907/4885LMNA 4819/4885ALDH1A1 524/4885
US-20140235807-A1 Use of Mercapto-Methyl Esters as Chain Transfer Agents MGMT, MPST, BHMT2 TSHR 4448/4885LMNA 4695/4885ALDH1A1 229/4885
US-20090240034-A1 METHOD FOR PRODUCING PEPTIDE THIOESTER PTMS, PPT1, NGLY1 TSHR 1448/4885LMNA 4397/4885ALDH1A1 4214/4885

“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.