SCHEMBL29587394

SCHEMBL29587394

Cc1ccc2c(c1)CNCC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PNMT P11086 8/20 0.60
ADRA2A P08913 3/20 0.60
ADRA2B P18089 2/20 0.60
ADRA2C P18825 2/20 0.60
DRD2 P14416 1/20 0.56
DRD3 P35462 1/20 0.56
CD44 P16070 1/20 0.54
MAOB P27338 1/20 0.54

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
SCHEMBL3240344 1.00 PNMT (0.60) PNMTADRA2AADRA2BADRA2CDRD2
Hydrochloric Acid SCHEMBL21331206 0.98 PNMT (0.58) PNMTADRA2AADRA2BADRA2CDRD2
Hydrochloric Acid SCHEMBL29587818 0.98 PNMT (0.58) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL1001109 0.92 ASIC3 (0.60) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL17813307 0.88 PNMT (0.47) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL10232037 0.87 HTR2C (0.57) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL15957848 0.86 PNMT (0.46) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL7216445 0.85 ASIC3 (0.54) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL30560114 0.82 CHRNB2 (0.41) PNMTADRA2AADRA2BADRA2C
SCHEMBL5068876 0.82 CHRNB2 (0.41) PNMTADRA2AADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059959-A Synthesis method and application of pyrrolo [2,1-a ] isoquinoline compound 河南工业大学 2026-05-19 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-122059959-A Synthesis method and application of pyrrolo [2,1-a ] isoquinoline compound 河南工业大学 2026-05-19 CN disclosed
CN-115872985-B 1,2,3, 4-Tetrahydroisoquinoline-thiophene derivative and preparation method thereof 赣江中药创新中心 2025-01-14 CN disclosed
CN-119243183-A Synthesis method of nitrosamine organic compound 中国科学技术大学 2025-01-03 CN disclosed
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 disclosed
CN-115626889-A Organic chemical conversion method for oxidative dehydrogenation of nitrogen-containing heterocyclic compound 南京工业大学 2023-01-20 CN disclosed
EP-4076459-A1 PRMT5 INHIBITORS Merck Sharp & Dohme LLC (US) 2022-10-26 EP disclosed
CN-112939943-B Benzimidazole compound, preparation method thereof and application of benzimidazole compound in preparation of iron death inhibitor 中山大学 2022-09-16 CN disclosed
CN-109863145-B Novel tetrahydroisoquinoline and tetrahydronaphthyridine compounds for the treatment and prevention of hepatitis b virus infection 豪夫迈·罗氏有限公司 2022-04-12 CN disclosed