SCHEMBL363383

SCHEMBL363383

c1ccc(N2CCCO2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
SIGMAR1 Q99720 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
ADRB1 P08588 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 1/20 0.35
AKR1C3 P42330 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
MBTD1 Q05BQ5 1/20 0.34
L3MBTL3 Q96JM7 1/20 0.34
ATM Q13315 2/20 0.33
CHRNA7 P36544 2/20 0.33

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
SCHEMBL27513171 0.93 LMNA (0.43) LMNASIGMAR1MEN1KMT2ANPC1
SCHEMBL2340643 0.84 LMNA (0.34) LMNAMEN1KMT2AHSD17B10ALOX5
SCHEMBL28073187 0.78
SCHEMBL10648796 0.78 ADRB1 (0.39) LMNAMEN1KMT2ANPC1RAB9A
SCHEMBL11593810 0.77 CHRNB2 (0.47) CHRNA7CYP3A4CHRNB2CHRNA3CHRNA4
SCHEMBL10515874 0.74 HTR3E (0.44) SIGMAR1KMT2ARAB9AHTR3EHTR3B
SCHEMBL21752062 0.72 LMNA (0.41) LMNASIGMAR1MEN1KMT2ANPC1
SCHEMBL1406399 0.72
SCHEMBL6049417 0.71 LMNA (0.43) LMNASIGMAR1MEN1KMT2ANPC1
SCHEMBL17027625 0.71 MEN1 (0.41) MEN1KMT2ACYP2C9CYP2C19L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112023662-B Composite desulfurizer for purifying petroleum and natural gas 宁波中一石化科技有限公司 2021-07-02 CN claimed
CN-112023662-A Composite desulfurizer for purifying petroleum and natural gas 宁波中一石化科技有限公司 2020-12-04 CN claimed
CN-107866147-B Preparation method of offshore oilfield liquid composite desulfurizer 中海油天津化工研究设计院有限公司 2020-10-30 CN claimed
US-20240109882-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORP (US) 2024-04-04 US disclosed
US-11897876-B2 Isoxazolidines as RIPK1 inhibitors and use thereof GENZYME CORPORATION (US) 2024-02-13 US disclosed
US-20230203027-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORPORATION 2023-06-29 US disclosed
WO-2023083847-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-05-19 WO disclosed
CN-112023662-B Composite desulfurizer for purifying petroleum and natural gas 宁波中一石化科技有限公司 2021-07-02 CN disclosed
CN-112023662-A Composite desulfurizer for purifying petroleum and natural gas 宁波中一石化科技有限公司 2020-12-04 CN disclosed
CN-107866147-B Preparation method of offshore oilfield liquid composite desulfurizer 中海油天津化工研究设计院有限公司 2020-10-30 CN disclosed
CN-108602809-A Inhibitors of isoxazolidine derived receptor interacting protein kinase 1(RIPK 1) 戴纳立制药公司 2018-09-28 CN disclosed
EP-2585443-B1 PROCESS FOR PRODUCING IMINE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2015-02-18 EP disclosed
US-8633231-B2 Substituted imidazolones, compositions containing such compounds and methods of use MERCK SHARP & DOHME CORP. (US) 2014-01-21 US disclosed
US-20130123315-A1 SUBSTITUTED IMIDAZOLONES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK SHARP & DOHME LLC 2013-05-16 US disclosed
EP-2552209-A1 NOVEL SPIRO IMIDAZOLONE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE Merck Sharp & Dohme Corp. (US) 2013-02-06 EP disclosed
US-20130012493-A1 NOVEL SPIRO IMIDAZOLONE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE MERCK SHARP & DOHME CORP. 2013-01-10 US disclosed
WO-2012009226-A1 SUBSTITUTED IMIDAZOLONES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK SHARP & DOHME CORP. (US) 2012-01-19 WO disclosed
WO-2011119541-A1 NOVEL SPIRO IMIDAZOLONE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE SCHERING CORPORATION (US) 2011-09-29 WO disclosed
US-6846957-B2 Synthesis of 3-aminomethyl-1-propanol, a fluoxetine precursor BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2005-01-25 US disclosed
US-20040102651-A1 Synthesis of 3-aminomethyl-1-propanol, a fluoxetine precursor BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2004-05-27 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 (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-20130012493-A1 NOVEL SPIRO IMIDAZOLONE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE GLP1R, GCGR, GIPR LMNA 1719/4885SIGMAR1 2217/4885MEN1 908/4885
US-20230203027-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK2, RIPK3 LMNA 3512/4885SIGMAR1 2075/4885MEN1 4437/4885
US-20240109882-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK2, RIPK3 LMNA 3512/4885SIGMAR1 2075/4885MEN1 4437/4885
US-11897876-B2 Isoxazolidines as RIPK1 inhibitors and use thereof RIPK1, RIPK2, RIPK3 LMNA 3512/4885SIGMAR1 2075/4885MEN1 4437/4885
US-20130123315-A1 SUBSTITUTED IMIDAZOLONES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE UGT2B7, CYP3A43, UGT1A7 LMNA 525/4885SIGMAR1 2057/4885MEN1 738/4885
US-20040102651-A1 Synthesis of 3-aminomethyl-1-propanol, a fluoxetine precursor TPH1, HTR1A, TPH2 LMNA 1046/4885SIGMAR1 351/4885MEN1 975/4885

“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.