SCHEMBL505055

SCHEMBL505055

Brc1ccc2c(c1)CCNC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 1.00
PNMT P11086 5/20 0.85
DRD2 P14416 2/20 0.56
DRD3 P35462 2/20 0.56
CD44 P16070 1/20 0.54
MAOB P27338 1/20 0.54
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
HTR2B P41595 1/20 0.51
ADRA2A P08913 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
PARP10 Q53GL7 1/20 0.46
PARP11 Q9NR21 1/20 0.46

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
Hydrochloric Acid SCHEMBL1017313 0.98 ASIC3 (0.96) ASIC3PNMTDRD2DRD3CD44
SCHEMBL29473102 0.92 PNMT (1.00) ASIC3PNMTDRD2DRD3CD44
SCHEMBL552932 0.92 PNMT (1.00) ASIC3PNMTDRD2DRD3CD44
Hydrochloric Acid SCHEMBL1266299 0.90 PNMT (0.96) ASIC3PNMTDRD2DRD3CD44
Hydrochloric Acid SCHEMBL29528420 0.90 PNMT (0.96) ASIC3PNMTDRD2DRD3CD44
SCHEMBL29758914 0.88 ASIC3 (0.79) ASIC3PNMTDRD2DRD3CD44
SCHEMBL1264714 0.88 ASIC3 (0.79) ASIC3PNMTDRD2DRD3CD44
SCHEMBL1264341 0.87 PNMT (0.77) ASIC3PNMTDRD2HTR2AHTR2C
Hydrochloric Acid SCHEMBL21753254 0.86 ASIC3 (0.76) ASIC3PNMTDRD2DRD3CD44
Hydrochloric Acid SCHEMBL21753269 0.85 PNMT (0.74) ASIC3PNMTDRD2HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119638623-A Synthesis process of 6-bromo-1, 2,3, 4-tetrahydroisoquinoline 苏州艾缇克药物化学有限公司 2025-03-18 CN claimed
CN-115894363-B Synthesis process of 6-bromo-1, 2,3, 4-tetrahydroisoquinoline 苏州艾缇克药物化学有限公司 2025-02-11 CN claimed
CN-115626889-B Organic chemical conversion method for oxidative dehydrogenation of nitrogen-containing heterocyclic compound 南京工业大学 2024-04-30 CN claimed
CN-115894363-A Synthesis process of 6-bromo-1,2,3,4-tetrahydroisoquinoline 苏州艾缇克药物化学有限公司 2023-04-04 CN claimed
CN-111621805-B Method for preparing 3, 4-dihydroisoquinoline by electrocatalytic selective dehydrogenation 天津大学 2022-02-18 CN claimed
CN-109943861-B Method for synthesizing alpha-phosphoramidate by electrochemical oxidation 南京大学 2020-11-27 CN claimed
CN-111621805-A Method for preparing 3, 4-dihydroisoquinoline by electrocatalytic selective dehydrogenation 天津大学 2020-09-04 CN claimed
WO-2026106389-A1 NMT INHIBITOR AND USE THEREOF 주식회사 이노보테라퓨틱스 2026-05-21 WO disclosed
CN-116829545-B Substituted pyrazolylpiperidine carboxylic acids 拜耳公司 2026-05-15 CN disclosed
EP-4720038-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2026-04-08 EP disclosed
EP-4713096-A1 CDK INHIBITOR COMPOUNDS Aleksia Therapeutics, Inc. (US) 2026-03-25 EP disclosed
US-20260034140-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LTD (GB) 2026-02-05 US disclosed
EP-4676476-A1 INHIBITORS OF TDP-43 AND TAU AGGREGATION Aquinnah Pharmaceuticals, Inc. (US) 2026-01-14 EP disclosed
US-20070078121-A1 Enzyme modulators and treatments DECIPHERA PHARMACEUTICALS, LLC 2007-04-05 US disclosed
WO-2006065216-A1 NOVEL HYDANTOIN DERIVATIVES AS METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 WO disclosed
WO-2006065215-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2006-06-22 WO disclosed
EP-1045843-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-10-24 EP disclosed
EP-1045843-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2000-10-25 EP disclosed
US-5977134-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-11-02 US disclosed
WO-1999028313-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1999-06-10 WO 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 (2 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-20260034140-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE ROCK1, ROCK2, RHOA ASIC3 2202/4885PNMT 3109/4885DRD2 2749/4885
US-20070078121-A1 Enzyme modulators and treatments ABL1, ABL2, LCK ASIC3 4164/4885PNMT 998/4885DRD2 4562/4885

“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.