SCHEMBL27705236

SCHEMBL27705236

[CH2]c1ccc2csccc1-2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 6/20 0.41
CYP2B6 P20813 3/20 0.41
CYP2E1 P05181 2/20 0.41
KCNH2 Q12809 1/20 0.39
TDO2 P48775 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PTPRC P08575 1/20 0.36
LPL P06858 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
GAA P10253 1/20 0.35
CYP17A1 P05093 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
IMPDH2 P12268 1/20 0.33
MAOB P27338 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL2094933 0.73 CYP2A6 (0.42) CYP2A6CYP2B6CYP2E1KCNH2TDO2
SCHEMBL277051 0.73 PELI1 (0.50) CYP2A6CYP2B6CYP2E1KCNH2TDO2
SCHEMBL22734811 0.70 CYP2A6 (0.52) CYP2A6CYP2B6CYP2E1KCNH2TDO2
SCHEMBL6295431 0.70 CYP2A6 (0.58) CYP2A6CYP2B6CYP2E1KCNH2CYP3A4
SCHEMBL27989815 0.69 CYP2A6 (0.74) CYP2A6CYP2B6CYP2E1KCNH2CYP3A4
SCHEMBL4946960 0.69 CYP2A6 (0.64) CYP2A6CYP2B6CYP2E1KCNH2TDO2
SCHEMBL6598549 0.69 MEN1 (0.39) CYP2A6CYP2B6CYP2E1KCNH2TDO2
SCHEMBL28681732 0.69 CYP2A6 (0.40) CYP2A6CYP2B6CYP2E1KCNH2TDO2
SCHEMBL28104229 0.69 MEN1 (0.36) CYP2A6CYP2B6CYP2E1KCNH2TDO2
SCHEMBL21295827 0.69 PTPRC (0.36) CYP2A6CYP2B6CYP2E1KCNH2TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106659161-B Amide compound and its harmful arthropod prevent and kill off purposes 住友化学株式会社 2019-08-02 CN disclosed
CN-106572659-B Harmful arthropod agent for preventing and eliminating containing amide compound 住友化学株式会社 2019-05-10 CN disclosed
CN-106659161-A Amide compound and use of same for noxious arthropod control 住友化学株式会社 2017-05-10 CN disclosed
CN-106572659-A Noxious arthropod control agent containing amide compound 住友化学株式会社 2017-04-19 CN disclosed
CN-106458903-A Method for producing heteroaromatic sulfonamide compound 宇部兴产株式会社 2017-02-22 CN disclosed
CN-106458904-A N-substituted sulfonamide compound and method for producing same 宇部兴产株式会社 2017-02-22 CN disclosed
CN-101142219-A Pyrazolopyrimidine derivative or pharmaceutically acceptable salt thereof TEIJIN PHARMA LTD (JP) 2008-03-12 CN disclosed