SCHEMBL28069185

SCHEMBL28069185

COc1nc(OC)c(Cl)c(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.46
ALDH1A1 P00352 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PAX8 Q06710 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
CD274 Q9NZQ7 5/20 0.32
PDCD1LG2 Q9BQ51 4/20 0.32
NPBWR1 P48145 1/20 0.30
MCHR1 Q99705 1/20 0.30
PDCD1 Q15116 1/20 0.30

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
SCHEMBL17302069 0.86 CYP1A2 (0.52) CYP1A2CYP2C19NPC1RAB9APAX8
SCHEMBL9432184 0.79 CYP1A2 (0.61) CYP1A2ALDH1A1SMN1; SMN2HIF1AMEN1
SCHEMBL7607691 0.75 CCNA2 (0.47) CYP1A2SMN1; SMN2GAACD274PDCD1LG2
SCHEMBL11017179 0.73 CYP1A2 (0.80) CYP1A2ALDH1A1SMN1; SMN2
SCHEMBL9538834 0.71 CYP1A2 (0.53) CYP1A2ALDH1A1CYP2C19NPC1RAB9A
SCHEMBL9432085 0.71 CYP1A2 (0.53) CYP1A2ALDH1A1SMN1; SMN2HIF1AMEN1
SCHEMBL5519307 0.71 TDP1 (0.44) CYP1A2ALDH1A1CYP2C19NPC1SMN1; SMN2
SCHEMBL8008714 0.69 CYP1A2 (0.52) CYP1A2SMN1; SMN2HIF1AGAA
SCHEMBL9432745 0.68 SMN1; SMN2 (0.50) CYP1A2ALDH1A1NPC1SMN1; SMN2HIF1A
SCHEMBL11647100 0.68 HIF1A (0.40) CYP1A2ALDH1A1SMN1; SMN2HIF1AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104507316-B Compositions comprising biological control agents and fungicides 拜尔农作物科学股份公司 2018-03-06 CN claimed
CN-107568247-A Include biocontrol agent and insecticide composition 拜耳农作物科学股份公司 2018-01-12 CN claimed
CN-104703473-B Composition comprising desinsection terpene blend and fungicide 拜耳农作物科学股份公司 2017-12-29 CN claimed
CN-106962403-A Include biocontrol agent and insecticide composition 拜耳作物科学股份公司 2017-07-21 CN claimed
CN-108477173-A Heterocyclic compound as insecticide 拜耳农作物科学股份公司 2018-09-04 CN disclosed
CN-108004235-A Soybean event SYHT0H2 and composition and method for its detection 先正达参股股份有限公司 2018-05-08 CN disclosed
CN-106661022-B Pyrazolopyridine sulfonamides as nematicides 拜耳作物科学股份公司 2018-05-04 CN disclosed
CN-105101800-B Heterocyclic Compounds as Pesticides 拜耳农作物科学股份公司 2018-04-13 CN disclosed
CN-105050392-B Reduce the composition of drift 科莱恩金融(BVI)有限公司 2018-04-03 CN disclosed
CN-105307492-B Binary desinsection or deinsectization mixture 拜耳作物科学股份公司 2018-03-30 CN disclosed
CN-107846888-A Heterocyclic compound as insecticide 拜耳作物科学股份公司 2018-03-27 CN disclosed
CN-107848975-A Nitrogen-containing heterocycles as pesticides 拜耳作物科学股份公司 2018-03-27 CN disclosed
CN-106795140-A Novel halogen substituted compounds 拜耳作物科学股份公司 2017-05-31 CN disclosed
CN-106715424-A Bicyclic compounds as pesticides 拜耳作物科学股份公司 2017-05-24 CN disclosed
CN-104270946-B Use of anthranilic acid diamide derivatives for controlling pests in transgenic crops 拜耳农作物科学股份公司 2017-05-10 CN disclosed
CN-106661022-A Pyrazolopyridine sulfonamides as nematicides 拜耳作物科学股份公司 2017-05-10 CN disclosed
CN-104244716-B Active compound combinations containing a thiazoylisoxazoline and a fungicide 拜耳知识产权有限责任公司 2017-05-03 CN disclosed
CN-104381250-B METHOD FOR SEED DRESSING 巴斯夫欧洲公司 2017-04-12 CN disclosed
CN-104011026-B Insecticidal aromatic amides 拜耳知识产权股份有限公司 2016-07-20 CN disclosed
CN-103947645-B 1-(pyridin-3-yl)-pyrazoles and 1-(pyrimidine-5-base)-pyrazoles as insecticide 拜尔农作物科学股份公司 2016-07-06 CN disclosed