SCHEMBL54535

SCHEMBL54535

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

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
HIF1A Q16665 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL54010 0.85 ALDH1A1 (0.58) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL11857113 0.83 ALDH1A1 (0.44) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL11383721 0.81 ALDH1A1 (0.42) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL11379731 0.81 ALDH1A1 (0.42) ALDH1A1LMNATP53CYP3A4HPGD
Captan SCHEMBL8409894 0.81 ALDH1A1 (0.69) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL3681253 0.81 ALDH1A1 (0.36) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL22930 0.77 ALDH1A1 (0.69) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL22931 0.77 ALDH1A1 (0.69) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL7029440 0.76 ALDH1A1 (0.67) ALDH1A1LMNATP53CYP3A4HPGD
SCHEMBL20395717 0.76 ALDH1A1 (0.67) ALDH1A1LMNATP53CYP3A4HPGD

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 1042 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5866514-A HIGH BOILING; ODORLESS; ANTISEPTICS, HERBICIES, INSECTICIDES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1999-02-02 US claimed
JP-57099502-A None JP disclosed
EP-2181593-B2 Use of specific alcohol alkoxylates as adjuvant for the agrotechnical sector BASF SE (DE) 2022-02-23 EP disclosed
CN-113853460-A Polyester fiber structure, method for producing same, clothing, and bedding 东丽株式会社 2021-12-28 CN disclosed
CN-108289454-B Microorganism control agent and miticidal composition 大阪燃气化学株式会社 2021-11-09 CN disclosed
EP-2181593-B1 Use of specific alcohol alkoxylates as adjuvant for the agrotechnical sector BASF SE (DE) 2016-08-24 EP disclosed
US-8877681-B2 Use of specific alcohol alkoxylates as an adjuvant for agrotechnical applications BASF SE (DE) 2014-11-04 US disclosed
US-8802120-B2 Bioactive agrichemical compositions and use thereof SCIESSENT LLC (US) 2014-08-12 US disclosed
EP-1659864-B1 METHOD OF PLANT GROWTH PROMOTION USING AMIDE COMPOUNDS BASF SE (DE) 2013-09-18 EP disclosed
EP-2551403-A1 DEODORANT FIBER STRUCTURE Toray Industries, Inc. (JP) 2013-01-30 EP disclosed
US-4069308-A VAPORIZATION WITH SUPERHEATED STEAM, RAPID COOLING SHOWA DENKO KABUSHIKI KAISHA (JA) 1978-01-17 US disclosed
US-4013717-A BENZOYL PHENYL UREA DERIVATIVES HAVING INSECTICIDAL ACTIVITIES U.S. PHILIPS CORPORATION (US) 1977-03-22 US disclosed
US-4010271-A NOVEL PYRAZOLINE COMPOUNDS HAVING INSECTICIDAL ACTIVITY U.S. PHILIPS CORPORATION (US) 1977-03-01 US disclosed
US-4001416-A PYRIDINECARBOXYLIC ACID DERIVATIVES BASF AKTIENGESELLSCHAFT (DT) 1977-01-04 US disclosed
US-3993772-A Certain N-methoxy-N-cycloalkyl-2-methyl-3-furancarboxamides and fungicidal method using same BASF AKTIENGESELLSCHAFT (DT) 1976-11-23 US disclosed
US-3991073-A Pyrazoline compounds having insecticidal activity U.S. PHILIPS CORPORATION (US) 1976-11-09 US disclosed
US-3989842-A Certain substituted benzoyl urea insecticides U.S. PHILIPS CORPORATION (US) 1976-11-02 US disclosed
US-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 US disclosed
US-3962444-A Use of 4-thiocyano-quinazolines as fungicides U.S. PHILIPS CORPORATION (US) 1976-06-08 US disclosed
US-3933908-A INSECTICIDE U.S. PHILIPS CORPORATION (US) 1976-01-20 US disclosed