SCHEMBL9804339

SCHEMBL9804339

N#CC(Br)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.60
PTGS1 P23219 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP2D6 P10635 1/20 0.48
ALOX5 P09917 1/20 0.46
AKR1C3 P42330 1/20 0.43
MAOB P27338 1/20 0.43
TSHR P16473 3/20 0.41
LTA4H P09960 1/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
CCR1 P32246 1/20 0.40
SGMS2 Q8NHU3 1/20 0.40
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL11353860 1.00 TRPA1 (0.60) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL11110203 0.89 TRPA1 (0.46) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL11327455 0.89 TRPA1 (0.46) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL10746067 0.83 PTGS1 (0.53) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL11202378 0.83 PTGS1 (0.53) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL7191294 0.83 PTGS1 (0.53) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL9664012 0.82 ALOX5 (0.55) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL13886757 0.81 PTGS1 (0.50) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL4449688 0.81 PTGS1 (0.50) TRPA1PTGS1MEN1KMT2ACYP2D6
SCHEMBL29175442 0.81 TRPA1 (0.52) TRPA1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116354850-B Preparation method of fenpropathrin 大连凯飞化学股份有限公司 2024-02-13 CN disclosed
CN-116354850-A Preparation method of fenpropathrin 大连凯飞化学股份有限公司 2023-06-30 CN disclosed
CN-1137091-C Prepn. of fenpropathrin 南开大学 2004-02-04 CN disclosed
CN-1357538-A Prepn. of fenpropathrin UNIV NANKAI (CN) 2002-07-10 CN disclosed
EP-0240121-B1 DIPHENYL ETHER DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-17 EP disclosed
EP-0390228-A2 Chemical intermediates IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-10-03 EP disclosed
US-4791139-A Diphenyl ether derivatives and their use as insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-12-13 US disclosed
EP-0240121-A2 Diphenyl ether derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-10-07 EP disclosed
US-4611009-A Combating arthropods with 3-phenoxybenzyl 2,2-dimethyl-3-vinylcyclopropane carboxylates BAYER AKTIENGESELLSCHAFT (DE) 1986-09-09 US disclosed
EP-0056271-B1 CARBOXYLIC ACID ESTERS AND INSECTICIDAL AND/OR ACARICIDAL COMPOSITIONS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-05-07 EP disclosed
US-4219563-A Cyclopropanecarboxylate pesticides SHELL OIL COMPANY (US) 1980-08-26 US disclosed
US-4211792-A Oxyimino-substituted (1R,trans)-cyclopropanecarboxylate pesticides SHELL OIL COMPANY (US) 1980-07-08 US disclosed
US-4209642-A Cyclopropylmethanol pesticide SHELL OIL COMPANY (US) 1980-06-24 US disclosed
EP-0005882-A1 A method of combating acarine pests by means of oxyimino-substituted cyclopropane-carboxylate esters, Z-isomers of certain such esters SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1979-12-12 EP disclosed
EP-0000345-A1 Substituted phenoxybenzyloxycarbonyl derivatives, their preparation and their use as insecticides and acaricides BAYER AG (DE) 1979-01-24 EP disclosed
EP-0000229-A1 Cyclopropyl carboxylate compounds, a process for their manufacture and their use as pesticides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1979-01-10 EP disclosed
US-4118413-A Preparation of phenoxybenzyl esters SHELL OIL COMPANY (US) 1978-10-03 US disclosed
US-4118510-A INSECTICIDE, MITICIDE SHELL OIL COMPANY (US) 1978-10-03 US disclosed
US-4100363-A 2-Substituted isovaleric acid ester pesticides SHELL OIL COMPANY (US) 1978-07-11 US disclosed
US-4100298-A Dispirocyclopropane carboxylate pesticides SHELL OIL COMPANY (US) 1978-07-11 US disclosed