SCHEMBL9320867

SCHEMBL9320867

CCCCN(CC)C(=S)OCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 9/20 0.53
CA1 P00915 9/20 0.53
CA9 Q16790 9/20 0.53
CA2 P00918 7/20 0.53
ALDH1A1 P00352 2/20 0.47
ALDH2 P05091 2/20 0.47
MGLL Q99685 2/20 0.46
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP2D6 P10635 1/20 0.36
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
EHMT2 Q96KQ7 3/20 0.34
EHMT1 Q9H9B1 3/20 0.34
ABCB11 O95342 2/20 0.34
HTT P42858 2/20 0.34
GSDMD P57764 2/20 0.34

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
SCHEMBL11349971 0.91 ALDH1A1 (0.50) CA12CA1CA9CA2ALDH1A1
SCHEMBL30493047 0.89 ALDH1A1 (0.48) CA12CA1CA9CA2ALDH1A1
SCHEMBL29083058 0.89 ALDH1A1 (0.48) CA12CA1CA9CA2ALDH1A1
SCHEMBL1702174 0.86 CA12 (0.52) CA12CA1CA9CA2ALDH1A1
SCHEMBL4015605 0.82 CA12 (0.43) CA12CA1CA9CA2ALDH1A1
SCHEMBL28178872 0.80 CA12 (0.42) CA12CA1CA9CA2ALDH1A1
SCHEMBL29694574 0.80 ALDH1A1 (0.40) CA12CA1CA9CA2ALDH1A1
SCHEMBL965514 0.78 ALDH1A1 (0.50) CA12CA1CA9CA2ALDH1A1
SCHEMBL4297986 0.78 ALDH1A1 (0.50) CA12CA1CA9CA2ALDH1A1
SCHEMBL2784462 0.78 CA12 (0.50) CA12CA1CA9CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121288984-A Method for improving sulfur-oxygen mixed copper ore beneficiation technical index 水口山有色金属有限责任公司 2026-01-09 CN disclosed
US-5308830-A Low dosage; nonphytotoxic to crops; pre- and postemergence ROHM AND HAAS COMPANY (US) 1994-05-03 US disclosed
US-5304531-A Preemergent, postemergent, controls weed growth 2-chloro-4-trifluoromethyl-3' (1-(carboethoxy) ethoxycarbonyl)-4-nitrodiphenyl ether BASF CORPORATION 1994-04-19 US disclosed
US-5290756-A Herbicides ROHM AND HAAS COMPANY (US) 1994-03-01 US disclosed
US-5214190-A Nitrophenyl ether herbicides JOHNSON WAYNE O (US) 1993-05-25 US disclosed
US-4894479-A CARBONYLOXYAMINO DERIVATIVES ROHM AND HAAS COMPANY (US) 1990-01-16 US disclosed
US-4877897-A HERBICIDES ROHM AND HAAS COMPANY (US) 1989-10-31 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
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