SCHEMBL3853864

SCHEMBL3853864

[CH2]CCNCCCN(C)C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.60
PAOX Q6QHF9 1/20 0.48
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
DPP7 Q9UHL4 2/20 0.43
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
PRMT3 O60678 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
PRMT1 Q99873 1/20 0.36
PRMT8 Q9NR22 1/20 0.36
ALOX15 P16050 1/20 0.36
TERT O14746 1/20 0.35
DNM1 Q05193 3/20 0.35
PKM P14618 1/20 0.34

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
SCHEMBL380271 0.93 TDP1 (0.52) TDP1PAOXCYP2C9CYP2C19DPP7
SCHEMBL15859 0.87 TDP1 (0.75) TDP1PAOXCYP2C9CYP2C19DPP7
SCHEMBL2461414 0.84
SCHEMBL5131831 0.84 TDP1 (0.71) TDP1PAOXCYP2C9CYP2C19DPP7
SCHEMBL26967080 0.84 TDP1 (0.71) TDP1PAOXCYP2C9CYP2C19DPP7
Ammonia Solution, Strong SCHEMBL7104676 0.84 TDP1 (0.71) TDP1PAOXCYP2C9CYP2C19DPP7
SCHEMBL5129514 0.84 TDP1 (0.71) TDP1PAOXCYP2C9CYP2C19DPP7
SCHEMBL7184727 0.82
SCHEMBL14943804 0.81 TDP1 (0.68) TDP1PAOXCYP2C9CYP2C19DPP7
SCHEMBL5131976 0.81 TDP1 (0.68) TDP1PAOXCYP2C9CYP2C19DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111793215-A Modified organopolysiloxane and preparation method and application thereof 唐山三友硅业有限责任公司 2020-10-20 CN claimed
CN-106459271-A Multifunctional acrylic oligomers of branched structure, by polyaddition between multifunctional amines and acrylates 阿科玛法国公司 2017-02-22 CN claimed
CN-111793215-B Modified organopolysiloxane, preparation method and application thereof 唐山三友硅业有限责任公司 2022-05-03 CN disclosed
CN-111793215-A Modified organopolysiloxane and preparation method and application thereof 唐山三友硅业有限责任公司 2020-10-20 CN disclosed
CN-106459271-A Multifunctional acrylic oligomers of branched structure, by polyaddition between multifunctional amines and acrylates 阿科玛法国公司 2017-02-22 CN disclosed
US-9346919-B2 Polysiloxane-polyether copolymers with amino groups and/or quaternary ammonium groups in the polyether moiety and processes for the preparation thereof EVONIK DEGUSSA GMBH (DE) 2016-05-24 US disclosed
WO-2015142689-A1 SLIP RESISTANT ARTICLE AND THE METHOD FOR PREPARING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-09-24 WO disclosed
US-20150080427-A1 BENZOQUINOLINE INHIBITORS OF VESICULAR MONOAMINE TRANSPORTER 2 AUSPEX PHARMACEUTICALS, INC. 2015-03-19 US disclosed
CN-102947362-B Foam insulation unit DOW GLOBAL TECHNOLOGIES LLC 2015-03-18 CN disclosed
US-20140303065-A1 Polysiloxane-polyether copolymers with amino groups and/or quaternary ammonium groups in the polyether moiety and processes for the preparation thereof EVONIK INDUSTRIES AG (DE) 2014-10-09 US disclosed
CN-102020672-B Alkoxy silicane functionalized betaine zwitterionic compound and preparation method and application thereof UNIV SOUTH CHINA TECH 2013-08-21 CN disclosed
CN-102020672-A Alkoxy silicane functionalized betaine zwitterionic compound and preparation method and application thereof UNIV SOUTH CHINA TECH 2011-04-20 CN disclosed
US-7582700-B2 Method for the production of emulsions of highly-viscous organopolysiloxanes WACKER CHEMIE AG (DE) 2009-09-01 US disclosed
EP-1773920-B1 METHOD FOR THE PRODUCTION OF EMULSIONS OF HIGHLY-VISCOUS ORGANOPOLYSILOXANES WACKER CHEMIE AG (DE) 2008-04-09 EP disclosed
US-20080033062-A1 Method for the Production of Emulsions of Highly-Viscous Organopolysiloxanes WACKER CHEMIE AG (DE) 2008-02-07 US disclosed
US-7126020-B2 Reactions rapidly complete or proceeds at low temperature such as room temperature; highly viscous and stable products with Si C-bonded radicals containing basic nitrogen WACKER CHEMIE AG (DE) 2006-10-24 US disclosed
EP-1541615-B1 Method for the production of highly viscous organopolysiloxanes WACKER CHEMIE AG (DE) 2006-03-22 EP disclosed
US-20050131243-A1 Process for preparing highly viscous organopolysiloxanes WACKER-CHEMIE GMBH (DE) 2005-06-16 US disclosed
EP-1541615-A1 Method for the production of highly viscous organopolysiloxanes Wacker-Chemie GmbH (DE) 2005-06-15 EP 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 (1 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-20150080427-A1 BENZOQUINOLINE INHIBITORS OF VESICULAR MONOAMINE TRANSPORTER 2 SLC18A2, SLC6A2, SLC18A1 TDP1 1159/4885PAOX 800/4885CYP2C9 801/4885

“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.