SCHEMBL18248463

SCHEMBL18248463

Fc1cc(F)c(-c2ccnnc2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.38
GABRA1 P14867 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
ACLY P53396 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
NOTUM Q6P988 2/20 0.34
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
ADORA1 P30542 1/20 0.34
STING1 Q86WV6 2/20 0.33
HDAC4 P56524 1/20 0.33
SCN9A Q15858 1/20 0.32
WNT3A P56704 1/20 0.32
KAT6A Q92794 1/20 0.32
S1PR1 P21453 1/20 0.32

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
SCHEMBL13911005 0.77 LOXL2 (0.40) CYP11B2PRMT5WDR77HDAC4S1PR1
SCHEMBL27821399 0.71 HDAC4 (0.41) CYP11B2NOTUMHDAC4WNT3AS1PR1
SCHEMBL20743619 0.71 LOXL2 (0.43) CYP11B2PRMT5WDR77HDAC4WNT3A
SCHEMBL10067780 0.69 VRK1 (0.44) CYP11B2ACLYHDAC4
SCHEMBL16139758 0.68 TDO2 (0.50) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL29582826 0.68 CYP11B2 (0.41) CYP11B2GABRA1GABRG2GABRB3GABRA5
SCHEMBL28264972 0.67 METAP2 (0.46) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL27821400 0.67 HDAC4 (0.44) GABRG2GABRB3GABRA5GABRA3NOTUM
SCHEMBL14926556 0.66 NOTUM (0.39) NOTUM
SCHEMBL13699080 0.66

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117412961-A Pesticidally active heteroaromatic compounds 先正达农作物保护股份公司 2024-01-16 CN disclosed
CN-116829521-A Synergistic effect of DCD and alkoxypyrazole as nitrification inhibitor 巴斯夫欧洲公司 2023-09-29 CN disclosed
EP-4017244-A1 APPARATUS AND METHOD FOR REDUCING DUST DEVELOPMENT IN PRECISION DRILL SOWING SYNGENTA PARTICIPATIONS AG (CH) 2022-06-29 EP disclosed
EP-3829303-A1 CONTROLLED RELEASE FORMULATIONS FOR AGROCHEMICALS Bayer Aktiengesellschaft (DE) 2021-06-09 EP disclosed
WO-2021032634-A1 APPARATUS AND METHOD FOR REDUCING DUST DEVELOPMENT IN PRECISION DRILL SOWING SYNGENTA PARTICIPATIONS AG (CH) 2021-02-25 WO disclosed
CN-108290886-B 2- (hetero) aryl-substituted fused bicyclic heterocyclic derivatives as pest control agents 拜耳作物科学股份公司 2020-11-03 CN disclosed
WO-2020021082-A1 CONTROLLED RELEASE FORMULATIONS FOR AGROCHEMICALS BAYER AKTIENGESELLSCHAFT (DE) 2020-01-30 WO disclosed
WO-2019150311-A1 1-3 DITHIOL COMPOUNDS AND THEIR USE FOR THE PROTECTION OF CROPS FROM PHYTOPATHOGENIC MICROORGANISMS PI INDUSTRIES LTD. (IN) 2019-08-08 WO disclosed
CN-109923112-A Kill the oxadiazole derivatives of microorganism 先正达参股股份有限公司 2019-06-21 CN disclosed
CN-109247339-A Purposes of the composition comprising biocontrol agent and fungicide as fungicide 拜耳作物科学股份公司 2019-01-22 CN disclosed
CN-104837350-B Use of a composition comprising a biological control agent and a fungicide as a fungicide 拜尔农作物科学股份公司 2018-08-03 CN disclosed
EP-3297439-A1 METHOD FOR TREATING COFFEE RUST, CITRUS BLACK SPOT, CITRUS SCAB AND BANANA BLACK SIGATOKA DISEASES Bayer CropScience Aktiengesellschaft (DE) 2018-03-28 EP disclosed
WO-2016184879-A1 METHOD FOR TREATING COFFEE RUST, CITRUS BLACK SPOT, CITRUS SCAB AND BANANA BLACK SIGATOKA DISEASES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-11-24 WO disclosed