SCHEMBL789013

SCHEMBL789013

CC1(C)N[C@H]2CCCCC[C@@H]2NC1=O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
HSD11B1 P28845 10/20 0.32
OPRM1 P35372 2/20 0.31
OPRL1 P41146 2/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31

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
SCHEMBL22402473 1.00 ALDH1A1 (0.37) ALDH1A1PKMHSD11B1OPRM1OPRL1
SCHEMBL788956 1.00 ALDH1A1 (0.37) ALDH1A1PKMHSD11B1OPRM1OPRL1
SCHEMBL788957 1.00 ALDH1A1 (0.37) ALDH1A1PKMHSD11B1OPRM1OPRL1
SCHEMBL789124 0.98 ALDH1A1 (0.38) ALDH1A1PKM
SCHEMBL789272 0.98 ALDH1A1 (0.38) ALDH1A1PKM
SCHEMBL9567813 0.98 ALDH1A1 (0.38) ALDH1A1PKM
SCHEMBL10752789 0.98 ALDH1A1 (0.38) ALDH1A1PKM
SCHEMBL789556 0.94 ALDH1A1 (0.33) ALDH1A1PKM
SCHEMBL789484 0.94 ALDH1A1 (0.33) ALDH1A1PKM
SCHEMBL16938253 0.94 ALDH1A1 (0.33) ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105832740-B Aryl amine purine derivative and preparation method thereof and purposes in medicine 石药集团中奇制药技术(石家庄)有限公司 2019-02-12 CN claimed
CN-103957883-B Comprising by the pretreating agent for keratin fiber of the methyl substituted silicone of 4 morpholinyls 汉高股份有限及两合公司 2017-06-23 CN claimed
CN-105832740-A Aromatic amino purine derivative as well as preparation method and pharmaceutical application thereof 石药集团中奇制药技术(石家庄)有限公司 2016-08-10 CN claimed
CN-102656180-B As the feather fan alcohol type triterpene derivative of antiviral drug HETERO RESEARCH FOUNDATION (IN) 2016-04-20 CN claimed
CN-103003278-B Arylamino purine derivatives, preparation method and medical application thereof CSPC ZHONGQI PHARMACEUTICAL TECHNOLOGY (SHIJIAZHUANG) Co.,Ltd. (CN) 2016-03-30 CN claimed
CN-105308036-A Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC 2016-02-03 CN claimed
CN-103957880-A Hair treatment agent comprising 4-morpholino-methyl-substituted silicone(s) HENKEL AG & CO KGAA 2014-07-30 CN claimed
CN-103957883-A Pretreatment agents for keratin fibers comprising 4-morpholino-methyl-substituted silicone(s) HENKEL AG & CO KGAA 2014-07-30 CN claimed
CN-101604607-A Coating composition for interconnection part of electrode and comprise its plasma display SAMSUNG SDI CO LTD (KR) 2009-12-16 CN claimed
CN-1849121-A Piperazine derivatives as bradyknin antagonist AMGEN INC (US) 2006-10-18 CN claimed
CN-1161336-C Quinoline carboxamides as antiviral agents �������Ŷ���Լ��������˾ 2004-08-11 CN claimed
CN-1432001-A 1-aryl-4-oxo-1,4-dihydro-3-quinolinecarboxamides as antiviral agents UPJOHN CO (US) 2003-07-23 CN claimed
CN-1390211-A Benzoic ester comprising ethoxyl acyl piperazine substituted oxazolidone compound UPJOHN CO (US) 2003-01-08 CN claimed
CN-1378537-A Pyrimidine derivatives ASTRAZENECA AB (SE) 2002-11-06 CN claimed
CN-1333753-A Quinoline carboxamides as antiviral agents UPJOHN CO (US) 2002-01-30 CN claimed
EP-3464321-B1 PROTEASOME INHIBITORS MAX PLANCK GESELLSCHAFT (DE) 2023-01-25 EP disclosed
US-11345724-B2 Proteasome inhibitors MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-05-31 US disclosed
CN-1038583-C Acylphenylglycine derivative and preventive and remedy for diseases caused by increased collagenase activity containing said compound as active ingredient KANEBO LTD (JP) 1998-06-03 CN disclosed
CN-1133034-A Acylphenylglycine derivative and preventive or remedy for diseases caused by increased collagenase activity containing the same as active ingredient KANEBO LTD (JP) 1996-10-09 CN disclosed
CN-1132505-A Amidine derivatives with nitric oxide synthetase activities ASTERA CO (SE) 1996-10-02 CN 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-11345724-B2 Proteasome inhibitors PSMB1, PSMB2, PSMB5 ALDH1A1 3319/4885PKM 2646/4885HSD11B1 1257/4885

“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.