SCHEMBL730714

SCHEMBL730714

O=C=C1C=CC=CN1

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
SCHEMBL11134192 0.97 — —
SCHEMBL4661726 0.97 — —
SCHEMBL30940538 0.97 — —
Hydrochloric Acid SCHEMBL9393513 0.97 — —
Water SCHEMBL27523845 0.97 — —
SCHEMBL28174902 0.80 NPC1 (0.32) —
SCHEMBL27671880 0.74 — —
SCHEMBL28175602 0.74 — —
SCHEMBL15286437 0.68 — —
SCHEMBL30593066 0.64 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109154093-B Electrolytic nickel (alloy) plating solution 日本高纯度化学株式会社 2020-11-27 — — CN claimed
CN-109154093-A Electrolytic nickel (alloy) plating liquid 日本高纯度化学株式会社 2019-01-04 — — CN claimed
EP-1915149-B1 NOVEL TRIAZOLE DERIVATIVES AS GHRELIN ANALOGUE LIGANDS OF GROWTH HORMONE SECRETAGOGUE RECEPTORS AETERNA ZENTARIS GMBH (DE) 2018-10-10 — — EP claimed
CN-104926971-B A kind of olefin polymerization solid catalyst and preparation method 中国石油化工股份有限公司 2017-03-29 — — CN claimed
CN-104109117-B A kind of 2-(tert-butylamine base) preparation method of carbonyl pyridine compound SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2016-05-25 — — CN claimed
CN-104926971-A Olefin polymerization solid catalyst and preparation method thereof CHINA PETROLEUM & CHEMICAL 2015-09-23 — — CN claimed
CN-104277217-A Imine bond-connected polymer material and preparation method thereof DALIAN CHEMICAL PHYSICS INST 2015-01-14 — — CN claimed
CN-104109117-A Preparation method of 2-(tert-butylamino)carbonylpyridine compound SHANGHAI INST PHARM INDUSTRY 2014-10-22 — — CN claimed
US-8710089-B2 Triazole derivatives as ghrelin analogue ligands of growth hormone secretagogue receptors ZENTARIS GMBH (DE) 2014-04-29 — — US claimed
EP-2668161-A1 METHOD AND SUBSTANCES FOR PREPARATION OF N-SUBSTITUTED PYRIDINIUM COMPOUNDS Roche Diagniostics GmbH (DE) 2013-12-04 — — EP claimed
US-20050054748-A1 Comprising a mono- and/or a polycyanoacrylate, a polymerizable monomer, a stabilizer, an initiator, pigments and a filling material; usable as dental filling material, dental cement, dental sealer or as dental adhesives; also usable in microelectronics as industrial adhesives or for medical applications KLEE JOACHIM E (DE) 2005-03-10 — — US claimed
CN-1579629-A Binuclear nickel-series olefine oligomerization catalyst, and its preparation method and use CHINA PETROCHEMICAL CORP (CN) 2005-02-16 — — CN claimed
CN-1411809-A Usage and composition of pyridine onium derivative for curing application TORENTO PHARMACEUTICAL CO LTD (IN) 2003-04-23 — — CN claimed
US-20020147249-A1 Dental composition DENTSPLY RESEARCH & DEVELOPMENT CORP. 2002-10-10 — — US claimed
US-20020025993-A1 DENTAL COMPOSITION DENTSPLY DETREY GMBH (DE) 2002-02-28 — — US claimed
EP-1137389-A1 DENTAL COMPOSITION DENTSPLY INTERNATIONAL, INC. (US) 2001-10-04 — — EP claimed
WO-2000033793-A1 DENTAL COMPOSITION DENTSPLY INTERNATIONAL INC. (US) 2000-06-15 — — WO claimed
EP-0411754-A2 Medicament for the inhibition of interleukin-1 or tumor necrosis factor production by monocytes and/or macrophages SMITHKLINE BEECHAM CORPORATION (US) 1991-02-06 — — EP claimed
WO-1991000092-A1 INHIBITION OF INTERLEUKIN-1 AND TUMOR NECROSIS FACTOR PRODUCTION BY MONOCYTES AND/OR MACROPHAGES SMITHKLINE BEECHAM CORPORATION (US) 1991-01-10 — — WO claimed
EP-0112262-A1 Benzylcarbamoylpyridine derivatives RHONE-POULENC AGROCHIMIE (FR) 1984-06-27 — — EP claimed
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