SCHEMBL211376

SCHEMBL211376

CCCCC(CC)CC(S)C(=O)O.CCCCC(CC)CC(S)C(=O)O.CCCCC(CC)CC(S)C(=O)O.C[SnH]

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 4/20 0.44
RNPEP Q9H4A4 3/20 0.44
CYP3A4 P08684 4/20 0.41
TSHR P16473 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
ATM Q13315 1/20 0.41
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.37
GPR84 Q9NQS5 2/20 0.36

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
SCHEMBL424113 0.96 CA2 (0.48) CA2MAPK1ALDH1A1RNPEPCYP3A4
Hydrogen Sulfide SCHEMBL8850278 0.95 CA2 (0.47) CA2MAPK1ALDH1A1RNPEPCYP3A4
SCHEMBL6361967 0.92 CA2 (0.42) CA2MAPK1ALDH1A1RNPEPCYP3A4
SCHEMBL28958204 0.91 CA2 (0.44) CA2MAPK1ALDH1A1RNPEPCYP3A4
Phosphoric Acid SCHEMBL4891228 0.90 CA2 (0.43) CA2MAPK1ALDH1A1RNPEPCYP3A4
SCHEMBL5324009 0.89 CA2 (0.40) CA2MAPK1ALDH1A1RNPEPCYP3A4
SCHEMBL8931815 0.85 CA2 (0.40) CA2MAPK1ALDH1A1RNPEPCYP3A4
SCHEMBL8931819 0.83 GMNN (0.39) CA2MAPK1ALDH1A1RNPEPCYP3A4
SCHEMBL9242496 0.81 CA2 (0.52) CA2MAPK1ALDH1A1RNPEPCYP3A4
SCHEMBL29133312 0.81 CA2 (0.47) CA2MAPK1ALDH1A1CYP3A4TSHR

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012143794-A1 POLYMER STABILIZER SYSTEM FOR POLYMERS CONTAINING HALOGEN GALATA CHEMICALS GMBH (DE) 2012-10-26 WO claimed
WO-2012143794-A1 POLYMER STABILIZER SYSTEM FOR POLYMERS CONTAINING HALOGEN GALATA CHEMICALS GMBH (DE) 2012-10-26 WO disclosed
US-8088937-B2 Alkyltin sulfanyl diester thiols GALATA CHEMICALS, LLC (US) 2012-01-03 US disclosed
US-20100298589-A1 Alkyltin Sulfanyl Diester Thiols GALATA CHEMICALS, LLC (US) 2010-11-25 US disclosed
US-20100280155-A1 Alkyltin Sulfanyl Mercaptocarboxylates Having Terminal Thiol Groups GALATA CHEMICALS, LLC (US) 2010-11-04 US disclosed
US-7781504-B2 Alkyltin sulfanyl diester thiols GALATA CHEMICALS, LLC (US) 2010-08-24 US disclosed
US-7767740-B2 Alkyltin sulfanyl mercaptocarboxylates having terminal thiol groups GALATA CHEMICALS, LLC (US) 2010-08-03 US disclosed
US-20100190902-A1 ALKYLTIN SULFANYL ESTER THIOLS CHEMTURA CORPORATION (US) 2010-07-29 US disclosed
US-20080132621-A1 Alkyltin sulfanyl diester thiols AQUA CLEAR INDUSTRIES, LLC 2008-06-05 US disclosed
EP-1877413-A1 ALKYLTIN SULFANYL MERCAPTOCARBOXYLATES HAVING TERMINAL THIOL GROUPS Chemtura USA Corporation (US) 2008-01-16 EP disclosed
WO-2006121647-A1 ALKYLTIN SULFANYL MERCAPTOCARBOXYLATES HAVING TERMINAL THIOL GROUPS CHEMTURA CORPORATION (US) 2006-11-16 WO disclosed
US-20060252859-A1 Alkyltin sulfanyl mercaptocarboxylates having terminal thiol groups UNIROYAL CHEMICAL COMPANY LIMITED (DELAWARE) 2006-11-09 US disclosed
EP-0237485-B1 Stabilized compositions of rigid PVC CIBA GEIGY AG (CH) 1995-01-18 EP disclosed
EP-0237485-A2 Stabilized compositions of rigid PVC CIBA-GEIGY AG (CH) 1987-09-16 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 (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-20100190902-A1 ALKYLTIN SULFANYL ESTER THIOLS SULT1E1, SULT1A1, TST CA2 4833/4885MAPK1 3169/4885ALDH1A1 2621/4885
US-20100298589-A1 Alkyltin Sulfanyl Diester Thiols TST, SULT1A1, SULT1E1 CA2 4860/4885MAPK1 2130/4885ALDH1A1 2623/4885
US-20080132621-A1 Alkyltin sulfanyl diester thiols TST, SULT1A1, SULT1E1 CA2 4860/4885MAPK1 2130/4885ALDH1A1 2623/4885

“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.