SCHEMBL536553

SCHEMBL536553

CCCc1coc2ccccc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.67
CYP11B1 P15538 3/20 0.55
CYP11B2 P19099 3/20 0.55
CYP17A1 P05093 1/20 0.55
CYP19A1 P11511 1/20 0.55
MAOA P21397 2/20 0.55
SIGMAR1 Q99720 2/20 0.51
PTPN1 P18031 1/20 0.49
CA2 P00918 3/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA9 Q16790 2/20 0.47
PDE10A Q9Y233 2/20 0.46
HTR1A P08908 1/20 0.45

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
SCHEMBL3277216 0.89 MAOB (0.61) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL12655257 0.87 MAOB (0.73) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL1252500 0.85 CA2 (0.51) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL293779 0.83 MAOB (0.67) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL20378369 0.82 MAOB (0.76) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL6557580 0.80 MAOB (1.00) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL293945 0.80 MAOB (0.63) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL28435190 0.79 MAOB (0.66) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL293340 0.79 MAOB (0.61) MAOBCYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL12386447 0.79 MTNR1A (0.48) MAOBCYP11B1CYP11B2CYP17A1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11076600-B2 Mixtures of cis-jasmone and bacillus amyloliquefaciens BASF SE (DE) 2021-08-03 US claimed
US-20180317498-A1 Mixtures of Cis-Jasmone and Bacillus Amyloliquefaciens BASF SE (DE) 2018-11-08 US claimed
EP-3057419-A1 AGRICULTURAL MIXTURES COMPRISING CARBOXAMIDE COMPOUND BASF Agrochemical Products B.V. (NL) 2016-08-24 EP claimed
EP-2922399-A1 PESTICIDAL MIXTURES BASF SE (DE) 2015-09-30 EP claimed
WO-2015055755-A1 AGRICULTURAL MIXTURES COMPRISING CARBOXAMIDE COMPOUND BASF SE (DE) 2015-04-23 WO claimed
WO-2014079814-A1 PESTICIDAL MIXTURES BASF SE (DE) 2014-05-30 WO claimed
EP-2688405-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2014-01-29 EP claimed
WO-2012127009-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2012-09-27 WO claimed
EP-2413691-A2 METHOD FOR REDUCING SUNBURN DAMAGE IN PLANTS BASF SE (DE) 2012-02-08 EP claimed
WO-2010115721-A2 METHOD FOR REDUCING SUNBURN DAMAGE IN PLANTS BASF SE (DE) 2010-10-14 WO claimed
EP-2061320-A2 FUNGICIDAL MIXTURES COMPRISING SUBSTITUTED 1-METHYLPYRAZOL-4-YLCARBOXANILIDES BASF SE (DE) 2009-05-27 EP claimed
WO-2008095890-A2 FUNGICIDAL MIXTURES COMPRISING SUBSTITUTED 1-METHYLPYRAZOL-4-YLCARBOXANILIDES BASF SE (DE) 2008-08-14 WO claimed
CN-104507317-B Composition comprising a biological control agent and a fungicide, use thereof, kit 拜尔农作物科学股份公司 2019-11-15 CN disclosed
CN-104519742-B Compositions comprising biological control agents and pesticides 拜尔农作物科学股份公司 2019-10-25 CN disclosed
US-10448639-B2 Fungicidal pyrazoles FMC CORPORATION (US) 2019-10-22 US disclosed
CN-109601554-A Including biocontrol agent and insecticide composition 拜尔农作物科学股份公司 2019-04-12 CN disclosed
WO-2012139987-A1 USE OF SUBSTITUTED DITHIINE-TETRACARBOXIMIDES FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2012-10-18 WO disclosed
EP-1871744-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2008-01-02 EP disclosed
WO-2006108792-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2006-10-19 WO disclosed
US-4153707-A Fungicidal isoxazolyl phenols and method of use THE UPJOHN COMPANY (US) 1979-05-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11076600-B2 Mixtures of cis-jasmone and bacillus amyloliquefaciens BAX, FASN, BAK1 MAOB 671/4885CYP11B1 458/4885CYP11B2 663/4885
US-20180317498-A1 Mixtures of Cis-Jasmone and Bacillus Amyloliquefaciens BAX, FASN, BAK1 MAOB 671/4885CYP11B1 458/4885CYP11B2 663/4885
US-10448639-B2 Fungicidal pyrazoles CBR3, CBR1, CYP2S1 MAOB 1111/4885CYP11B1 149/4885CYP11B2 178/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.