SCHEMBL3681253

SCHEMBL3681253

O=C1C2C=CCCC2C(=O)N1SC(Cl)C(Cl)(Cl)Cl

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 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
SCHEMBL54535 0.81 ALDH1A1 (0.42) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL54010 0.80 ALDH1A1 (0.58) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL11857113 0.77 ALDH1A1 (0.44) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL11383721 0.75 ALDH1A1 (0.42) ALDH1A1LMNATP53CYP3A4HPGD
Captan SCHEMBL8409894 0.75 ALDH1A1 (0.69) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL11379731 0.75 ALDH1A1 (0.42) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL5448489 0.71 ALDH1A1 (0.32) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL11705923 0.67
Zinc Ion SCHEMBL11233374 0.66 ALDH1A1 (0.42) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL3728142 0.65 ALDH1A1 (0.38) ALDH1A1CYP3A4TSHR

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
JP-57099502-A None JP disclosed
US-7723418-B2 Antistatic resin composition SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-05-25 US disclosed
US-7514139-B2 A fiber, sheet or textile of a polyurethane formed from an anionic bis(hydroxy(oxy)alkyl) di- or oligoester prepared from a dicarboxylic acid containing one or two sulfonate, sulfate or sulfamate groups (e.g., 5-sulfoisophthalic acid); moisture-absorbing/releasing properties and dyeability SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2009-04-07 US disclosed
US-20060182922-A1 Polyol component for polyurethane formation comprising anionic diol and composition SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2006-08-17 US disclosed
US-20050049360-A1 Mixture of thermoplastic resin and antistatic agents; polyamideesterether block polymers SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2005-03-03 US disclosed
EP-0753255-B1 Pesticidal compositions comprising diarylalkanes NIPPON PETROCHEMICALS CO LTD (JP) 2000-12-20 EP disclosed
US-5866514-A HIGH BOILING; ODORLESS; ANTISEPTICS, HERBICIES, INSECTICIDES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1999-02-02 US disclosed
EP-0753255-A2 Pesticidal compositions comprising diarylalkanes NIPPON PETROCHEMICALS CO., LTD. (JP) 1997-01-15 EP disclosed
EP-0213718-B1 1-DIMETHYLCARBAMOYL-3-SUBSTITUTED-5-SUBSTITUTED-1H-1,2,4-TRIAZOLES ROHM AND HAAS COMPANY (US) 1991-06-12 EP disclosed
EP-0234622-A1 New thio compounds having fungicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1987-09-02 EP disclosed
EP-0213718-A2 1-Dimethylcarbamoyl-3-substituted-5-substituted-1H-1,2,4-triazoles ROHM AND HAAS COMPANY (US) 1987-03-11 EP disclosed
EP-0079635-A1 Arylphenyl ethers having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1983-05-25 EP disclosed
JP-S5799502-A SOIL STERILIZING COMPOSITION KANESHO KK 1982-06-21 JP disclosed
US-4069308-A VAPORIZATION WITH SUPERHEATED STEAM, RAPID COOLING SHOWA DENKO KABUSHIKI KAISHA (JA) 1978-01-17 US disclosed