SCHEMBL1701165

SCHEMBL1701165

CCCOC(=S)N(CCC)CCC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA12 O43570 9/20 0.48
CA2 P00918 9/20 0.48
CA9 Q16790 9/20 0.48
CA1 P00915 8/20 0.48
HPGD P15428 2/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ALDH2 P05091 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HCAR2 Q8TDS4 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
SCHEMBL29467086 0.93 CA12 (0.50) CA12CA2CA9CA1HPGD
SCHEMBL17764216 0.92 CA12 (0.41) CA12CA2CA9CA1HPGD
SCHEMBL9715892 0.91 CA12 (0.44) CA12CA2CA9CA1HPGD
SCHEMBL2784462 0.83 CA12 (0.50) CA12CA2CA9CA1HPGD
SCHEMBL21221409 0.83 CA12 (0.50) CA12CA2CA9CA1HPGD
SCHEMBL8772643 0.80 ALDH1A1 (0.42) CA12CA2CA9CA1HPGD
SCHEMBL965514 0.79 ALDH1A1 (0.50) CA12CA2CA9CA1ALDH1A1
SCHEMBL1702174 0.79 CA12 (0.52) CA12CA2CA9CA1HPGD
SCHEMBL27327402 0.78 CA12 (0.38) CA12CA2CA9CA1CHRNB2
SCHEMBL28777918 0.77 CA12 (0.34) CA12CA2CA9CA1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1024488-C Benzhydryl compounds as henbicide antidotes MONSANTO CO (US) 1994-05-18 CN claimed
CN-108348886-A The method for preparing microcapsules by double emulsifications 卡莉西亚公司 2018-07-31 CN disclosed
EP-3319433-A1 HERBICIDAL COMPOSITION COMPRISING CINMETHYLIN AND SPECIFIC NON-ACCASE LIPID SYNTHESIS INHIBITORS BASF Agro B.V. (NL) 2018-05-16 EP disclosed
WO-2017009134-A1 HERBICIDAL COMPOSITION COMPRISING CINMETHYLIN AND SPECIFIC NON-ACCASE LIPID SYNTHESIS INHIBITORS BASF Agro B.V. (NL) 2017-01-19 WO disclosed
WO-2012003441-A1 SELF-EMULSIFYING OIL ISP INVESTMENTS INC. (US) 2012-01-05 WO disclosed
EP-1945344-A2 PHOTO-RESPONSIVE MICROENCAPSULATION MATERIALS, COMPOSITIONS AND METHODS OF USE THEREOF Solarbre, Inc. (US) 2008-07-23 EP disclosed
WO-2007051198-A2 PHOTO-RESPONSIVE MICROENCAPSULATION MATERIALS, COMPOSITIONS AND METHODS OF USE THEREOF SOLARBRE, INC (US) 2007-05-03 WO disclosed
US-7019046-B2 Aqueous suspension agent for water insoluble compounds ISP INVESTMENTS INC. (US) 2006-03-28 US disclosed
WO-2006023409-A1 SOLID POLYMERIC DISPERSANT COMPOSITION FOR WATER-INSOLUBLE ACTIVES ISP INVESTMENTS INC. (US) 2006-03-02 WO disclosed
US-20060039944-A1 Solid polymeric dispersant composition for water-insoluble actives ISP INVESTMENTS INC. 2006-02-23 US disclosed
US-4863507-A Herbicidal 4-trifluoromethyl-4-nitrodiphenyl ethers ROHM AND HAAS COMPANY (US) 1989-09-05 US disclosed
US-4686294-A 1,3,4-thiadiazolyl ureas and processes for controlling weeds and wild grasses therewith CIBA-GEIGY CORPORATION (US) 1987-08-11 US disclosed
US-4439229-A Substituted phthalimides herbicides ROHM AND HAAS COMPANY (US) 1984-03-27 US disclosed
US-4386954-A Herbicidal diphenyl ethers ROHM AND HAAS COMPANY (US) 1983-06-07 US disclosed
EP-0068822-A2 Novel heterocyclic substituted benzenes, herbicidal compositions containing them and the use thereof for combating weeds ROHM AND HAAS COMPANY (US) 1983-01-05 EP disclosed
US-4321371-A Substituted N-benzoylanthranilic acid derivatives and their anhydro compounds BASF AKTIENGESELLSCHAFT (DE) 1982-03-23 US disclosed
US-4283547-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1981-08-11 US disclosed
US-4263040-A Phenoxyphenoxy unsaturated derivatives and herbicidal composition KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1981-04-21 US disclosed
EP-0020052-A1 Novel substituted nitrodiphenyl ethers, herbicidal compositions containing them, processes for the preparation thereof and the use thereof for combating weeds ROHM AND HAAS COMPANY (US) 1980-12-10 EP disclosed
US-3953427-A Process for the preparation of substituted S-alkyl thio-carbamates ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1976-04-27 US disclosed