Dodecane

Dodecane

SCHEMBL28149202

CCCCCCCCCCCC.O=S(=O)(O)Cc1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.50
HPGD P15428 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CETP P11597 4/20 0.47
EPHX2 P34913 2/20 0.47
PKM P14618 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NAAA Q02083 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46
MMP13 P45452 1/20 0.46

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
Phenylmethanesulfonic Acid SCHEMBL19282776 0.93 MEN1 (0.53) HPGDALDH1A1CETPMEN1KMT2A
Phenylmethanesulfonic Acid SCHEMBL7064029 0.92 CNR2 (0.45) CNR2HPGDALDH1A1CETPEPHX2
Phenylmethanesulfonic Acid SCHEMBL1985262 0.90 PRSS1 (0.50) HPGDALDH1A1KMT2ACA1CA2
Tetrabuthylammonium SCHEMBL6870890 0.90 CNR2 (0.44) CNR2HPGDALDH1A1MEN1KMT2A
Phenylmethanesulfonic Acid SCHEMBL28261868 0.90 HPGD (0.43) CNR2HPGDALDH1A1CETPEPHX2
Phenylmethanesulfonic Acid SCHEMBL30892409 0.89 CNR2 (0.52) CNR2SIGMAR1
Octadecanoic Acid Amide SCHEMBL27568667 0.89 EPHX2 (0.50) CNR2HPGDALDH1A1EPHX2MEN1
Cetrimonium SCHEMBL27682881 0.89 DNM1 (0.51) CNR2HPGDALDH1A1MEN1KMT2A
Phenylmethanesulfonic Acid SCHEMBL31747005 0.87 CSNK1E (0.51) CNR2HPGDALDH1A1EPHX2CA1
Phenylmethanesulfonic Acid SCHEMBL6344581 0.87 CNR2 (0.42) CNR2HPGDALDH1A1CETPEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104066331-B Harmful organism mixture is killed containing Spiroheterocyclic pyrrolidine dione 先正达参股股份有限公司 2018-07-13 CN disclosed
CN-105722839-B Pesticidally active bicyclic heterocycles with sulphur-containing substituents 先正达参股股份有限公司 2018-04-06 CN disclosed
CN-105431433-B Pesticidally active bicyclic or tricyclic heterocycles with sulfur-containing substituents 先正达参股股份有限公司 2018-04-06 CN disclosed
CN-107652292-A There are two rings or tricyclic heterocyclic with sulfur-bearing substituent for killing harmful organism activity 先正达参股股份有限公司 2018-02-02 CN disclosed
CN-106942245-A Harmful organism mixture is killed containing Spiroheterocyclic pyrrolidine dione 先正达参股股份有限公司 2017-07-14 CN disclosed
CN-104053360-B Harmful organism mixture is killed containing Spiroheterocyclic pyrrolidine dione 先正达参股股份有限公司 2017-06-09 CN disclosed
CN-104053362-B Pesticidal mixtures containing spiroheterocyclic pyrrolidine diones 先正达参股股份有限公司 2017-04-26 CN disclosed
CN-105636439-A Herbicidal compounds SYNGENTA PARTICIPATIONS AG 2016-06-01 CN disclosed
CN-103501611-B Herbicidal composition SYNGENTA LTD. (GB) 2016-05-11 CN disclosed
CN-104114536-A Polymorphic form of N- (2-methoxylbenzoyl) -4- [ (methylaminocarbonyl) amino ] benzenesulfonamide SYNGENTA LTD 2014-10-22 CN disclosed
CN-103347865-A Herbicidal compounds SYNGENTA LTD 2013-10-09 CN disclosed
CN-103003239-A Spiroheterocyclic pyrrolidine derivatives based pesticides SYNGENTA PARTICIPATIONS AG 2013-03-27 CN disclosed
CN-103003277-A 1, 8 -diazaspiro [4.5] decane- 2, 4 -dione derivatives useful as pesticides SYNGENTA PARTICIPATIONS AG 2013-03-27 CN disclosed
CN-103002731-A Pesticidal compositions SYNGENTA PARTICIPATIONS AG 2013-03-27 CN disclosed
CN-103002741-A Method of crop enhancement SYNGENTA PARTICIPATIONS AG 2013-03-27 CN disclosed
CN-103003276-A 1, 8 -diazaspiro [4.5] decane- 2, 4 -dione derivatives useful as pesticides SYNGENTA PARTICIPATIONS AG 2013-03-27 CN disclosed
CN-103002740-A Pesticidal compositions SYNGENTA PARTICIPATIONS AG 2013-03-27 CN disclosed
CN-102971295-A Chemical compounds SYNGENTA LTD 2013-03-13 CN disclosed
CN-102711464-A Herbicidal compositions comprising, and methods of use of, herbicidally active pyrandiones SYNGENTA LTD 2012-10-03 CN disclosed
CN-102711465-A Herbicidal composition comprising a pyrandione herbicide and a co-herbicide SYNGENTA LTD 2012-10-03 CN disclosed