SCHEMBL4360185

SCHEMBL4360185

CC(C)c1cc(Oc2ccccc2)cc(C(C)C)c1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
NLRP3 Q96P20 1/20 0.47
MAOB P27338 1/20 0.47
MAOA P21397 1/20 0.47
LTA4H P09960 4/20 0.46
TSHR P16473 1/20 0.46
BCL2 P10415 1/20 0.43
MCL1 Q07820 1/20 0.43
PTGS1 P23219 1/20 0.41
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MITF O75030 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
GFER P55789 1/20 0.39
NLRP1 Q9C000 1/20 0.39
NOD2 Q9HC29 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
Hydrochloric Acid SCHEMBL9364864 0.98 MEN1 (0.50) MEN1KMT2ANPC1RAB9ANLRP3
Water SCHEMBL28207329 0.98 MEN1 (0.46) MEN1KMT2ANPC1RAB9ANLRP3
SCHEMBL3941962 0.88 ALDH1A1 (0.37) TSHRALDH1A1SMN1; SMN2GAAGFER
SCHEMBL5076801 0.81 BCL2 (0.57) LTA4HTSHRBCL2MCL1PTGS1
SCHEMBL9637947 0.80 NPY5R (0.35) MEN1KMT2ANPC1RAB9ANLRP3
SCHEMBL9702892 0.78 PARP10 (0.43) MEN1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL9702388 0.78 XIAP (0.45) ALDH1A1SMN1; SMN2GAAMAPTHPGD
SCHEMBL27899937 0.78 PARP10 (0.50) MEN1KMT2ABCL2MCL1PTGS1
Hydrochloric Acid SCHEMBL27899942 0.76 PARP10 (0.49) MEN1KMT2ANPC1RAB9ANLRP3
Water SCHEMBL28207330 0.76 PARP10 (0.49) MEN1KMT2ABCL2MCL1PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957066-A Energy-saving and efficient synthesis method of diafenthiuron 江苏长青农化南通有限公司 2022-08-30 CN claimed
CN-113651705-A 4-phenoxy-2, 6-diisopropylaniline intermediate and preparation method and application thereof 襄阳金达成精细化工有限公司 2021-11-16 CN claimed
CN-113024428-A Synthetic method of novel thiourea diafenthiuron for killing insects and mites 江苏长青农化股份有限公司 2021-06-25 CN claimed
CN-103724213-B A kind of synthetic method of 2,6-di-isopropyl-4-phenoxybenzamine XINFA PHARMACEUTICAL CO., LTD. (CN) 2015-08-12 CN claimed
CN-103724213-A Synthetic method for 2,6-diisopropyl-4-phenoxy aniline XINFA PHARMACEUTICAL CO LTD 2014-04-16 CN claimed
CN-102993075-A Synthesis process for diafenthiuron as thiourea insecticide and acaricide JIANGSU CHANGQING AGROCHEMICAL CO LTD 2013-03-27 CN claimed
JP-4210959-A None JP disclosed
CN-119954701-A Synthesis method of diafenthiuron 青岛润农化工有限公司 2025-05-09 CN disclosed
CN-118791413-B Synthesis method of diafenthiuron 青岛润农化工有限公司 2025-04-18 CN disclosed
CN-119143331-A Improved method for recovering bromine from bromine-containing wastewater obtained in production of diafenthiuron 襄阳金达成精细化工有限公司 2024-12-17 CN disclosed
CN-118954681-A Air floatation oil removal system and method and oil removal process for wastewater in diafenthiuron production 襄阳金达成精细化工有限公司 2024-11-15 CN disclosed
CN-118791413-A Synthesis method of diafenthiuron 青岛润农化工有限公司 2024-10-18 CN disclosed
CN-112250547-B Phenol recovery method for potassium phenol-containing wastewater from production of diafenthiuron 襄阳金达成精细化工有限公司 2022-11-22 CN disclosed
EP-0435824-B1 Process for the preparation of isothiocyanates CIBA GEIGY AG (CH) 1994-03-30 EP disclosed
JP-H04210959-A NEW ISOTHIOCYANATE CIBA GEIGY AG 1992-08-03 JP disclosed
EP-0435824-A1 Process for the preparation of isothiocyanates CIBA-GEIGY AG (CH) 1991-07-03 EP disclosed
US-4997967-A Process for the preparation of isothiocyanates CIBA-GEIGY CORPORATION (US) 1991-03-05 US disclosed
US-4939257-A Phenoxyphenylthioureas CIBA-GEIGY CORPORATION (US) 1990-07-03 US disclosed
WO-1982003390-A1 ERIVATIVES OF PHENOXY-PHENYLE-ISOTHIO-UREA,INTERMEDIARY PRODUCTS BASED ON PHENOXY-PHENYLE-THIO-UREA,PREPARATION THEREOF AND THEIR UTILIZATION AGAINST INSECTS CIBA GEIGY AG (CH) 1982-10-14 WO disclosed
US-4328247-A Phenoxyphenylisothioureas, production thereof and use thereof in pest control, and phenoxyphenylthioureas as intermediates for the production of the phenoxyphenylisothioureas and use thereof in pest control CIBA-GEIGY CORPORATION (US) 1982-05-04 US disclosed