SCHEMBL3240122

SCHEMBL3240122

OCc1ccc2c(c1)CNCC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PNMT P11086 5/20 0.55
ADRA2A P08913 1/20 0.55
ADRA2B P18089 1/20 0.55
ADRA2C P18825 1/20 0.55
DRD2 P14416 1/20 0.51
DRD3 P35462 1/20 0.51
CD44 P16070 1/20 0.48
MAOB P27338 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
Hydrochloric Acid SCHEMBL22465809 0.98 PNMT (0.53) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL29867656 0.93 ASIC3 (0.55) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL120623 0.93 ASIC3 (0.55) PNMTADRA2AADRA2BADRA2CDRD2
Hydrochloric Acid SCHEMBL4789548 0.91 ASIC3 (0.53) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL18766202 0.89 HTR2C (0.52) ADRA2AADRA2BADRA2CDRD2DRD3
SCHEMBL1206291 0.84 HTR2A (0.40) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL31514914 0.84 HTR2A (0.40) PNMTADRA2AADRA2BADRA2CDRD2
Hydrochloric Acid SCHEMBL3710885 0.82 HTR2A (0.39) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL22542171 0.81 PNMT (0.55) PNMTADRA2AADRA2BADRA2CDRD2
SCHEMBL13650345 0.81 PNMT (0.55) PNMTADRA2AADRA2BADRA2CDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1227803-B1 COMPOUNDS FOR INHIBITING IAPP-ASSOCIATED AMYLOID DEPOSITS BELLUS HEALTH INTERNATIONAL LTD (CH) 2010-05-05 EP claimed
US-6562836-B1 Islet amyloid polypeptide (IAPP) is known to be capable of forming fibrils which are deposited in the pancreas of patients wtih type II diabetes QUEEN'S UNIVERSITY OF KINGSTON (CA) 2003-05-13 US claimed
US-11365192-B2 Pyridine compound substituted with azole TAISHO PHARMACEUTICAL CO., LTD. (JP) 2022-06-21 US disclosed
US-20210122741-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE TAISHO PHARMACEUTICAL CO., LTD (JP) 2021-04-29 US disclosed
EP-3666766-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE Taisho Pharmaceutical Co., Ltd. (JP) 2020-06-17 EP disclosed
CN-110914254-A Azole-substituted pyridine compound 大正制药株式会社 2020-03-24 CN disclosed
EP-3002278-B1 GUANIDINE COMPOUND ASTELLAS PHARMA INC (JP) 2017-04-19 EP disclosed
US-7786174-B2 Methods and compounds for inhibiting amyloid deposits BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2010-08-31 US disclosed
EP-1227803-B1 COMPOUNDS FOR INHIBITING IAPP-ASSOCIATED AMYLOID DEPOSITS BELLUS HEALTH INTERNATIONAL LTD (CH) 2010-05-05 EP disclosed
US-20080227767-A1 Administering a compound that inhibits islet amyloid polypeptide-associated amyloid deposition, e.g., 8-hydroxy-5-quinolinesulfonic acid, sodium cyclohexylsulfamate, or octahydroisoquinolinyl-N-propanesulfonic acid; antidiabetic agents NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2008-09-18 US disclosed
US-7393875-B2 Reducing islet amyloid polypeptide (IAPP) associated deposit; type II diabetes NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2008-07-01 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 (3 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-20210122741-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE CYP2C19, CYP4A11, CYP11B1 PNMT 1090/4885ADRA2A 2513/4885ADRA2B 1565/4885
US-20080227767-A1 Administering a compound that inhibits islet amyloid polypeptide-associated amyloid deposition, e.g., 8-hydroxy-5-quinolinesulfonic acid, sodium cyclohexylsulfamate, or octahydroisoquinolinyl-N-propanesulfonic acid; antidiabetic agents IAPP, APP, AMY2A PNMT 2173/4885ADRA2A 2050/4885ADRA2B 1861/4885
US-11365192-B2 Pyridine compound substituted with azole CYP2C19, CYP4A11, CYP11B1 PNMT 1090/4885ADRA2A 2513/4885ADRA2B 1565/4885

“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.