SCHEMBL318570

SCHEMBL318570

NCc1ccc(N)nc1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL29911003 1.00
Hydrochloric Acid SCHEMBL1432350 0.98 GABRP (0.53)
SCHEMBL25054208 0.81 GABRP (0.52)
Hydrochloric Acid SCHEMBL23201156 0.79 GABRP (0.50)
SCHEMBL5343427 0.78
SCHEMBL642783 0.78
SCHEMBL17058360 0.78
SCHEMBL11888555 0.78
SCHEMBL14425020 0.78
SCHEMBL312816 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115011048-A Preparation method and application of polyvinyl chloride antibacterial composite material 广东亮丰达实业有限公司 2022-09-06 CN claimed
CN-107337634-B A kind of preparation method of Abbe Seeley midbody compound 新发药业有限公司 2019-07-09 CN claimed
EP-2038264-B1 TETRAZOLE-SUBSTITUTED ARYLAMIDES HOFFMANN LA ROCHE (CH) 2016-10-26 EP claimed
CN-101495464-B Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV 2014-03-05 CN claimed
CN-103396398-A Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV 2013-11-20 CN claimed
EP-2585069-A1 PROKINETICIN 1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PAIN Janssen Pharmaceutica, N.V. (BE) 2013-05-01 EP claimed
EP-1973886-B1 PROKINETICIN 1 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2013-02-27 EP claimed
WO-2012006004-A1 PROKINETICIN 1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PAIN JANSSEN PHARMACEUTICA NV (BE) 2012-01-12 WO claimed
US-20110319400-A1 PROKINETICIN 1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PAIN JANSSEN PHARMACEUTICA, NV (BE) 2011-12-29 US claimed
EP-2385042-A1 Prokineticin 1 receptor antagonists Janssen Pharmaceutica N.V. (BE) 2011-11-09 EP claimed
WO-2007079214-A2 PROKINETICIN 2 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-12 WO claimed
EP-1362054-A1 BICYCLIC PYRIMIDINE MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP claimed
WO-2002064599-A1 BICYCLIC PYRIMIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed
EP-0934064-A4 THROMBIN INHIBITORS MERCK & CO INC (US) 2002-01-09 EP claimed
EP-0934064-A1 THROMBIN INHIBITORS Merck & Co., Inc. (US) 1999-08-11 EP claimed
WO-1998017274-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 1998-04-30 WO claimed
EP-0607804-B1 Process for the preparation of 2-amino-5-aminomethylpyridine BAYER AG (DE) 1996-07-10 EP claimed
US-5478944-A Process for the preparation of 2-amino-5-aminomethyl-pyridine BAYER AKTIENGESELLSCHAFT (DE) 1995-12-26 US claimed
EP-0658162-A1 CARBAPENEM DERIVATIVES AND PROCESSES FOR PREPARING THE SAME DONG-A PHARM. CO., LTD. (KR) 1995-06-21 EP claimed
EP-0607804-A1 Process for the preparation of 2-amino-5-aminomethylpyridine BAYER AG (DE) 1994-07-27 EP claimed