SCHEMBL278474

SCHEMBL278474

CC(C)NC(C)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.57
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ACP3 P15309 2/20 0.52
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
CHRM2 P08172 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CHRM1 P11229 1/20 0.48
SMPD1 P17405 1/20 0.48
DRD1 P21728 1/20 0.48
TBXA2R P21731 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
ADRA1A P35348 1/20 0.48
OPRM1 P35372 1/20 0.48
DRD3 P35462 1/20 0.48
CASR P41180 1/20 0.48

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
SCHEMBL8433113 1.00 SIGMAR1 (0.57) SIGMAR1GAAL3MBTL1ACP3CYP3A4
SCHEMBL8433689 1.00 SIGMAR1 (0.57) SIGMAR1GAAL3MBTL1ACP3CYP3A4
Benzene SCHEMBL10772069 1.00 SIGMAR1 (0.57) SIGMAR1GAAL3MBTL1ACP3CYP3A4
SCHEMBL5399360 0.97 SIGMAR1 (0.55) SIGMAR1GAAL3MBTL1ACP3CYP3A4
SCHEMBL283979 0.89 SIGMAR1 (0.61) SIGMAR1GAAL3MBTL1ACP3CYP3A4
SCHEMBL30763462 0.89 SIGMAR1 (0.61) SIGMAR1GAAL3MBTL1ACP3CYP3A4
SCHEMBL3749295 0.89 SIGMAR1 (0.61) SIGMAR1GAAL3MBTL1ACP3CYP3A4
SCHEMBL8437895 0.89 SIGMAR1 (0.61) SIGMAR1GAAL3MBTL1ACP3CYP3A4
SCHEMBL1200137 0.89 SIGMAR1 (0.61) SIGMAR1GAAL3MBTL1ACP3CYP3A4
Hydrochloric Acid SCHEMBL607712 0.86 SIGMAR1 (0.59) SIGMAR1GAAL3MBTL1ACP3CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109336887-B Benzimidazole chiral heterocyclic compound and preparation method and application thereof 中山大学 2021-12-17 CN claimed
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
CN-117327050-A Bimetal synergistic promotion system and application thereof in asymmetric synthesis of (S, S) -TBAJ-587 上海交通大学 2024-01-02 CN disclosed
US-11857519-B2 Compounds and methods for the targeted degradation of enhancer of zeste homolog 2 polypeptide ARVINAS OPERATIONS, INC. (US) 2024-01-02 US disclosed
US-11857519-B2 Compounds and methods for the targeted degradation of enhancer of zeste homolog 2 polypeptide ARVINAS OPERATIONS, INC. (US) 2024-01-02 US disclosed
US-11833208-B2 PLK1 selective degradation inducing compound UPPTHERA, INC. (KR) 2023-12-05 US disclosed
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 US disclosed
US-20230159446-A1 Methods and Compositions for Targeting Tregs using CCR8 Inhibitors NANJING IMMUNOPHAGE BIOMEDICAL CO., LTD. (CN) 2023-05-25 US disclosed
US-20230041518-A1 QUINOLINE DERIVATIVES GILEAD SCIENCES, INC. 2023-02-09 US disclosed
US-20230033360-A1 COMPOUNDS AS CD73 INHIBITORS BIOARDIS LLC 2023-02-02 US disclosed
US-20070105832-A1 Substituted azetidinones Cadrenal Therapeutics, Inc. 2007-05-10 US disclosed
US-7179940-B2 (Aryl)(amino) borane compounds, method for preparing same CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2007-02-20 US disclosed
US-7179940-B2 (Aryl)(amino) borane compounds, method for preparing same CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2007-02-20 US disclosed
US-20070037803-A1 2-Amino-imidazole derivatives; modulate the expression and/or function of proteins involved in inflammation, immune response regulation and cell proliferation AMGEN SF, LLC (US) 2007-02-15 US disclosed
US-20070032433-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION CORVAS INTERNATIONAL, LTD. 2007-02-08 US disclosed
EP-1458729-B1 (ARYL) (AMINO) BORANE COMPOUNDS, METHOD FOR PREPARING SAME CENTRE NAT RECH SCIENT (FR) 2006-03-08 EP disclosed
US-20040097560-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY 2004-05-20 US disclosed
US-5977409-A Method of using α-substituted benzylamine chiral auxiliary synthetic reagents UNIVERSITY OF TOLEDO (US) 1999-11-02 US disclosed
US-4958029-A Process for the production of isoindoline derivatives, novel intermediates and process for their production BANYU PHARMACEUTICAL CO., LTD. (JP) 1990-09-18 US disclosed
EP-0275064-A2 Process for the production of isoindoline derivatives, novel intermediates and process for their production Banyu Pharmaceutical Co., Ltd. (JP) 1988-07-20 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 (11 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-20070105832-A1 Substituted azetidinones F2R, CPA3, CFD SIGMAR1 4607/4885GAA 507/4885L3MBTL1 4390/4885
US-20230159446-A1 Methods and Compositions for Targeting Tregs using CCR8 Inhibitors CCR8, CCR1, CCR3 SIGMAR1 4425/4885GAA 3646/4885L3MBTL1 4338/4885
US-20230033360-A1 COMPOUNDS AS CD73 INHIBITORS ENTPD5, ENTPD1, NT5E SIGMAR1 4818/4885GAA 195/4885L3MBTL1 3880/4885
US-20040097560-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones IL17A, CYP51A1, CD4 SIGMAR1 1452/4885GAA 1885/4885L3MBTL1 2289/4885
US-20070037803-A1 2-Amino-imidazole derivatives; modulate the expression and/or function of proteins involved in inflammation, immune response regulation and cell proliferation IDO2, IRF2BP2, IRF3 SIGMAR1 4477/4885GAA 4796/4885L3MBTL1 4114/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 SIGMAR1 2905/4885GAA 1274/4885L3MBTL1 1477/4885
US-20230041518-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 SIGMAR1 709/4885GAA 252/4885L3MBTL1 4861/4885
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use UCHL1, ADRM1, CRBN SIGMAR1 2774/4885GAA 265/4885L3MBTL1 479/4885
US-11857519-B2 Compounds and methods for the targeted degradation of enhancer of zeste homolog 2 polypeptide CRBN, MDM2, VHL SIGMAR1 4536/4885GAA 486/4885L3MBTL1 401/4885
US-20070032433-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus HPN, TMPRSS15, VIP SIGMAR1 3270/4885GAA 725/4885L3MBTL1 1897/4885
US-11833208-B2 PLK1 selective degradation inducing compound PLK1, BUB1B, BUB1 SIGMAR1 4807/4885GAA 2410/4885L3MBTL1 719/4885

“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.