SCHEMBL1509610

SCHEMBL1509610

NC(=O)C1Cc2ccccc2CN1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 1/20 0.52
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
PRCP P42785 1/20 0.46
SMYD3 Q9H7B4 1/20 0.45
PNMT P11086 4/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL4666835 1.00 SCN3A (0.52) SCN3AMEN1KMT2APRCPSMYD3
SCHEMBL29474880 1.00 SCN3A (0.52) SCN3AMEN1KMT2APRCPSMYD3
SCHEMBL32677003 1.00 SCN3A (0.52) SCN3AMEN1KMT2APRCPSMYD3
SCHEMBL32677100 1.00 SCN3A (0.52) SCN3AMEN1KMT2APRCPSMYD3
Hydrochloric Acid SCHEMBL30225627 0.98 MEN1 (0.51) SCN3AMEN1KMT2APRCPSMYD3
Hydrochloric Acid SCHEMBL29897791 0.98 MEN1 (0.51) SCN3AMEN1KMT2APRCPSMYD3
Hydrochloric Acid SCHEMBL27787267 0.98 MEN1 (0.51) SCN3AMEN1KMT2APRCPSMYD3
Hydrochloric Acid SCHEMBL4787147 0.98 MEN1 (0.51) SCN3AMEN1KMT2APRCPSMYD3
SCHEMBL288272 0.83 GAA (0.58) MEN1KMT2APRCPPNMTOPRM1
SCHEMBL288260 0.83 GAA (0.58) MEN1KMT2APRCPPNMTOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512832-A1 TETRAHYDROISOQUINOLINE KAPPA OPIOID ANTAGONISTS Research Triangle Institute, International (US) 2019-07-24 EP claimed
CN-109790125-A TETRAHYDROISOQUINOLINE KAPPA OPIOID ANTAGONISTS 研究三角协会 2019-05-21 CN claimed
WO-2018053222-A1 TETRAHYDROISOQUINOLINE KAPPA OPIOID ANTAGONISTS RESEARCH TRAINGLE INSTITUTE (US) 2018-03-22 WO claimed
CN-104540806-B Azaheterocycles as BIR2 and/or BIR3 inhibitors 霍夫曼-拉罗奇有限公司 2017-05-03 CN claimed
US-20160108406-A1 METHOD OF REGULATING CFTR EXPRESSION AND PROCESSING UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2016-04-21 US claimed
EP-2195034-A2 PEPTIDE-PEPTIDASE INHIBITOR CONJUGATES AND METHODS OF MAKING AND USING SAME Amylin Pharmaceuticals, Inc. (US) 2010-06-16 EP claimed
EP-2125799-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE Smithkline Beecham Corporation (US) 2009-12-02 EP claimed
WO-2009042922-A2 PEPTIDE-PEPTIDASE INHIBITOR CONJUGATES AND METHODS OF MAKING AND USING SAME AMYLIN PHARMACEUTICALS, INC. (US) 2009-04-02 WO claimed
WO-2008104524-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE SMITHKLINE BEECHAM CORPORATION (US) 2008-09-04 WO claimed
WO-2006055951-A2 TETRAHYDROISOQUINOLINES AS FACTOR XA INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2006-05-26 WO claimed
WO-1998047877-A1 2-BENZOYL-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF HEPATIC PRODUCTION OF APOB-100 GLAXO GROUP LIMITED (GB) 1998-10-29 WO claimed
US-20260049060-A1 TETRAHYDROISOQUINOLINYLMETHYLBENZAMIDE COMPOUNDS NATIONAL HEALTH RES INST (TW) 2026-02-19 US disclosed
US-12503455-B2 Nucleic acid-binding photoprobes and uses thereof ARRAKIS THERAPEUTICS, INC. (US) 2025-12-23 US disclosed
US-20240158372-A1 BISAMIDE SARCOMERE ACTIVATING COMPOUNDS AND USES THEREOF AMGEN INC. 2024-05-16 US disclosed
US-11807623-B2 Nucleic acid-binding photoprobes and uses thereof ARRAKIS THERAPEUTICS, INC. (US) 2023-11-07 US disclosed
US-5994545-A TETRAHYDROISOQUINOLINE-3(S)-CARBOXYLIC ACID N-CARBOXY ANHYDRIDE; INTERMEDIATES OF SAQUINAVIR (EP 432694). AJINOMOTO CO., INC. (JP) 1999-11-30 US disclosed
US-5948886-A ELASTASE INHIBITORS OR PRODRUGS; FOR TREATMENT OF EMPHYSEMA, CYSTIC FIBROSIS, ADULT RESPIRATORY DISTRESS SYNDROME, GOUT, DISSEMINATED INTRAVASCULAR COAGULATION, RHEUMATOID ARTHRITIS, CHRONIC BRONCHITIS, INFLAMMATORY BOWEL DISEASE, SEPTICEMIA HOECHST MARION ROUSSEL, INC. (US) 1999-09-07 US disclosed
EP-0751128-B1 Process for producing optically active amides AJINOMOTO KK (JP) 1999-07-28 EP disclosed
WO-1998047877-A1 2-BENZOYL-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF HEPATIC PRODUCTION OF APOB-100 GLAXO GROUP LIMITED (GB) 1998-10-29 WO disclosed
EP-0751128-A1 Process for producing optically active amides Ajinomoto Co., Ltd. (JP) 1997-01-02 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 (5 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-20260049060-A1 TETRAHYDROISOQUINOLINYLMETHYLBENZAMIDE COMPOUNDS OPRK1, OPRD1, OPRM1 SCN3A 929/4885MEN1 4872/4885KMT2A 3661/4885
US-20240158372-A1 BISAMIDE SARCOMERE ACTIVATING COMPOUNDS AND USES THEREOF TNNI3, TNNT2, TNNC1 SCN3A 149/4885MEN1 4097/4885KMT2A 1593/4885
US-12503455-B2 Nucleic acid-binding photoprobes and uses thereof NSUN3, NSUN2, TARBP1 SCN3A 4664/4885MEN1 4474/4885KMT2A 2159/4885
US-20160108406-A1 METHOD OF REGULATING CFTR EXPRESSION AND PROCESSING CFTR, NEDD8, SCNN1B SCN3A 474/4885MEN1 2750/4885KMT2A 2228/4885
US-11807623-B2 Nucleic acid-binding photoprobes and uses thereof NSUN3, NSUN2, TARBP1 SCN3A 4664/4885MEN1 4474/4885KMT2A 2159/4885

“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.