SCHEMBL1429706

SCHEMBL1429706

CC(C)NC(C)C.CCN(CC)CC

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL27798996 0.97 TDP1 (0.50) TDP1
N,N-Dimethylethanaminium SCHEMBL2146563 0.80 TDP1 (0.53) TDP1
Bromoethane SCHEMBL11526729 0.79 TDP1 (0.61) TDP1
Isobutane SCHEMBL28239716 0.78 CHRM2 (0.36)
SCHEMBL9376579 0.75
SCHEMBL28021736 0.74 TDP1 (0.67) TDP1
SCHEMBL11058310 0.73 TDP1 (0.53) TDP1
SCHEMBL2020 0.73
SCHEMBL124190 0.73
SCHEMBL30 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240140983-A1 SINGLE STRANDED DNA ENZYME INHIBITORS MASSEY UNIVERSITY (NZ) 2024-05-02 US disclosed
CN-110248969-A Method for continuous synthesis of modified diene elastomers using lithium amide initiators 米其林集团总公司 2019-09-17 CN disclosed
US-20180155270-A1 PROCESS FOR PREPARATION OF CINACALCET INTERMEDIATE AND CINACALCET HYDROCHLORIDE LUPIN LIMITED (IN) 2018-06-07 US disclosed
EP-3143015-A1 HETEROARYL COMPOUNDS FOR KINASE INHIBITION ARIAD Pharmaceuticals, Inc. (US) 2017-03-22 EP disclosed
WO-2016193882-A1 PROCESS FOR PREPARATION OF CINACALCET INTERMEDIATE AND CINACALCET HYDROCHLORIDE LUPIN LIMITED (IN) 2016-12-08 WO disclosed
CN-105272829-A Synthetic method for 2,6-dichlorophenol LIANYUNGANG ZHICHENG CHEMICAL CO LTD 2016-01-27 CN disclosed
WO-2015175632-A1 HETEROARYL COMPOUNDS FOR KINASE INHIBITION ARIAD PHARMACEUTICALS, INC. (US) 2015-11-19 WO disclosed
US-9006271-B2 5-[5-[2-(3,5-bis(trifluoromethyl)phenyl)-2-methylpropanomethylpropanoylmethylamino]-4-(4-fluoro-2-methylphenyl)]-2-pyridinyl-2-alkyl-prolinamide as NK1 receptor antagonists NERRE THERAPEUTICS LIMITED (GB) 2015-04-14 US disclosed
US-20140249188-A1 5-[5-[2-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-2-METHYLPROPANOMETHYLPROPANOYLMETHYLAMINO]-4-(4-FLUORO-2-METHYLPHENYL)]-2-PYRIDINYL-2-ALKYL-PROLINAMIDE AS NK1 RECEPTOR ANTAGONISTS NERRE THERAPEUTICS LIMITED (GB) 2014-09-04 US disclosed
US-8822504-B2 5-[5-[2-(3,5-bis(trifluoromethyl)phenyl)-2-methylpropanomethylpropanoylmethylamino]-4-(4-fluoro-2-methylphenyl)]-2-pyridinyl-2-alkyl-prolinamide as NK1 receptor antagonists NERRE THERAPEUTICS LIMITED (GB) 2014-09-02 US disclosed
US-20110060015-A1 5-[5-[2-(3,5-BIS(Trifluoromethyl)Phenyl)-2-MethylpropanoMethylpropanoylmethylamino]-4-(4-Fluoro-2-Methylphenyl)]-2-Pyridinyl-2-Alkyl-Prolinamide As NK1 Receptor Antagonists NERRE THERAPEUTICS LIMITED (GB) 2011-03-10 US disclosed
WO-2009138393-A1 5-[5-[2-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-2-METHYLPROPANOYLMETHYLAMINO]-4-(4-FLUORO-2-METHYLPHENYL)]-2-PYRIDINYL-2-ALKYL-PROLINAMIDE AS NK1 RECEPTOR ANTAGONISTS GLAXO WELLCOME MANUFACTURING PTE LTD (SG) 2009-11-19 WO disclosed
US-20090286836-A1 Novel Compounds NERRE THERAPEUTICS LIMITED (GB) 2009-11-19 US disclosed
US-7482358-B2 Imidazoline compounds BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-01-27 US disclosed
US-20060135559-A1 Novel imidazoline compounds MSD K.K. (JP) 2006-06-22 US disclosed
EP-1264826-B1 NOVEL IMIDAZOLINE COMPOUNDS BANYU PHARMA CO LTD (JP) 2005-03-30 EP disclosed
EP-1264826-A1 NOVEL IMIDAZOLINE COMPOUNDS BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 EP disclosed
US-5231184-A Viricide intermediate JANSSEN PHARMACEUTICA N.V. (BE) 1993-07-27 US disclosed
EP-0056154-B1 PROCESS FOR THE PREPARATION OF 2,2-DIMETHYL-3-VINYL-CYCLOPROPANE-CARBOXYLIC ACIDS AND THEIR ESTERS BAYER AG (DE) 1984-05-23 EP disclosed
EP-0056154-A1 Process for the preparation of 2,2-dimethyl-3-vinyl-cyclopropane-carboxylic acids and their esters BAYER AG (DE) 1982-07-21 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 (6 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-20060135559-A1 Novel imidazoline compounds GPR119, NPY1R, NPY2R TDP1 1823/4885
US-20180155270-A1 PROCESS FOR PREPARATION OF CINACALCET INTERMEDIATE AND CINACALCET HYDROCHLORIDE SI, ACSL4, C9 TDP1 4497/4885
US-20090286836-A1 Novel Compounds MRGPRX1, MRGPRX2, MRGPRX4 TDP1 4222/4885
US-20240140983-A1 SINGLE STRANDED DNA ENZYME INHIBITORS APOBEC3A, APOBEC3C, APOBEC3G TDP1 29/4885
US-20110060015-A1 5-[5-[2-(3,5-BIS(Trifluoromethyl)Phenyl)-2-MethylpropanoMethylpropanoylmethylamino]-4-(4-Fluoro-2-Methylphenyl)]-2-Pyridinyl-2-Alkyl-Prolinamide As NK1 Receptor Antagonists TACR1, BDKRB2, TACR2 TDP1 3988/4885
US-20140249188-A1 5-[5-[2-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-2-METHYLPROPANOMETHYLPROPANOYLMETHYLAMINO]-4-(4-FLUORO-2-METHYLPHENYL)]-2-PYRIDINYL-2-ALKYL-PROLINAMIDE AS NK1 RECEPTOR ANTAGONISTS TACR1, BDKRB2, TACR2 TDP1 3988/4885

“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.