SCHEMBL8178016

SCHEMBL8178016

O=S(=O)(O)c1ccccc1-c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.53
PTGS1 P23219 1/20 0.53
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 1/20 0.45
SLC6A4 P31645 1/20 0.45
SLC6A3 Q01959 1/20 0.45
HSP90AA1 P07900 2/20 0.43
HSP90AB1 P08238 2/20 0.43
FGFR1 P11362 1/20 0.42
SRC P12931 1/20 0.42
FGFR2 P21802 1/20 0.42
FGFR4 P22455 1/20 0.42
FGFR3 P22607 1/20 0.42
NAT1 P18440 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL15849847 0.84 PTGS2 (0.47) PTGS2ALDH1A1RAB9AMAPTHPGD
SCHEMBL8597480 0.84 PTGS2 (0.47) PTGS2ALDH1A1RAB9AMAPTHPGD
SCHEMBL250146 0.84 PTGS2 (0.56) PTGS2PTGS1KDM4EALDH1A1RAB9A
SCHEMBL232659 0.84 CASP1 (0.47) PTGS2ALDH1A1HPGD
SCHEMBL29743050 0.84 CASP1 (0.47) PTGS2ALDH1A1HPGD
SCHEMBL5320291 0.82 TSHR (0.52) PTGS2PTGS1ALDH1A1
SCHEMBL890902 0.82 ABL1 (0.48) RAB9AMAPTF10MAOB
SCHEMBL4202592 0.82 PTGS2 (0.55) PTGS2PTGS1KDM4EALDH1A1RAB9A
SCHEMBL28934633 0.82 CASP1 (0.46) PTGS2ALDH1A1HPGD
SCHEMBL29353151 0.82 PTGS2 (0.48) PTGS2ALDH1A1RAB9ACYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6013836-A PARTICULARLY ACTIVE AGAINST MOTHS AND BEETLES AND THEIR INSECT GROWTH REGULATING ACTIVITY WITHOUT ADVERSE IMPACT ON BENEFICIAL INSECTS; CROPS; FORESTRY ROHM AND HAAS COMPANY (US) 2000-01-11 US disclosed
US-5470984-A Insecticides, molluscicides SHELL RESEARCH LIMITED (GB) 1995-11-28 US disclosed
US-5354762-A Insecticides ROHM AND HAAS COMPANY (US) 1994-10-11 US disclosed
US-5342958-A Insecticides SOLVAY DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1994-08-30 US disclosed
EP-0338685-B1 1-Dimethylcarbamoyl-3-substituted-5-substituted-1H-1,2,4-triazoles SHELL INT RESEARCH (NL) 1994-06-29 EP disclosed
US-5319092-A Insecticides, miticides, aphidicides, molluscicides and plant growth regulators SHELL RESEARCH LIMITED (GB) 1994-06-07 US disclosed
EP-0311284-B1 Insecticidal hydrogenated neem extracts ROHM & HAAS (US) 1994-04-06 EP disclosed
US-5245071-A Insecticides DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1993-09-14 US disclosed
EP-0347216-B1 INSECTICIDAL N'-SUBSTITUTED-N-ALKYLCARBONYL-N'-ACYLHYDRAZINES AND N'-SUBSTITUTED -N-ACYL-N'-ALKYLCARBONYL HYDRAZINES ROHM AND HAAS COMPANY (US) 1993-09-01 EP disclosed
US-5225443-A Lepidotera and Coleoptera insecticides to protect plants ROHM AND HAAS COMPANY (US) 1993-07-06 US disclosed
US-3960947-A FORMAMIDINE COMPOUNDS, PESTICIDES CIBA-GEIGY CORPORATION (US) 1976-06-01 US disclosed
US-3956306-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1976-05-11 US disclosed
US-3948940-A Pesticidal phthalimido phosphorous ester compounds CIBA-GEIGY CORPORATION (US) 1976-04-06 US disclosed
US-3941829-A PESTICIDE CIBA-GEIGY CORPORATION (US) 1976-03-02 US disclosed
US-3940412-A 2,4,5-Trichloro- and 2,4,5-tribromoimidazole derivatives and pesticidal compositions containing them CIBA-GEIGY AG (CH) 1976-02-24 US disclosed
US-3935224-A 4H-Pyrido[3,2a]-1,3,2-dioxophosphorane derivatives CIBA-GEIGY CORPORATION (US) 1976-01-27 US disclosed
US-3933908-A INSECTICIDE U.S. PHILIPS CORPORATION (US) 1976-01-20 US disclosed
US-3933945-A O-ethyl-S-(n)propyl-S-diallylcarbmoylmethyldithiophosphate CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed
US-3932629-A Triazolyl phosphorus esters as pesticides CIBA-GEIGY CORPORATION (US) 1976-01-13 US disclosed
US-3932630-A Triazolyl phosphorus esters as pesticides CIBA-GEIGY CORPORATION (US) 1976-01-13 US disclosed