SCHEMBL2413432

SCHEMBL2413432

O=C1CC2CC=CC2O1

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
SCHEMBL2413428 1.00
SCHEMBL9737504 0.79 SMN1; SMN2 (0.33)
SCHEMBL17694174 0.75 SMN1; SMN2 (0.30)
SCHEMBL17694176 0.75 SMN1; SMN2 (0.30)
SCHEMBL785507 0.71 SMN1; SMN2 (0.37)
SCHEMBL8930186 0.71
SCHEMBL4092129 0.67
SCHEMBL4092128 0.67
SCHEMBL11553602 0.65 CA1 (0.38)
SCHEMBL11325110 0.65 CA1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111777500-A Process for synthesizing cis-jasmone 昆山亚香香料股份有限公司 2020-10-16 CN claimed
US-11970557-B2 Polymer containing photoacid generator LG CHEM, LTD. (KR) 2024-04-30 US disclosed
US-20210102021-A1 POLYMER CONTAINING PHOTOACID GENERATOR LG CHEM, LTD. (KR) 2021-04-08 US disclosed
CN-111777500-A Process for synthesizing cis-jasmone 昆山亚香香料股份有限公司 2020-10-16 CN disclosed
EP-2369924-B1 NITROOXY CYCLOALKANE DERIVATIVES MERCK SHARP & DOHME (US) 2014-11-26 EP disclosed
US-8530521-B2 Nitrooxy cycloalkane derivatives MERCK SHARP & DOHME CORP. (US) 2013-09-10 US disclosed
US-20110230532-A1 NITROOXY CYCLOALKANE DERIVATIVES MERCK SHARP & DOHME LLC 2011-09-22 US disclosed
US-7371505-B2 Photosensitive composition and method for forming pattern using the same FUJIFILM CORPORATION (JP) 2008-05-13 US disclosed
EP-1644384-A2 PROCESS AND INTERMEDIATES FOR SYNTHESIS ENTECAVIR Bristol-Myers Squibb Company (US) 2006-04-12 EP disclosed
WO-2004052310-A2 PROCESS AND INTERMEDIATES FOR SYNTHESIS ENTECAVIR BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-24 WO disclosed
US-6433004-B1 GLUTAMATE RECEPTOR AGONISTS OR ANTAGONISTS FOR TREATMENT OF NERVOUS SYSTEM, PSYCHOLOGICAL, AND BRAIN DISORDERS; ANTISPASMODIC, ANTIISCHEMIC, AND ANALGESIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2002-08-13 US disclosed
EP-1047685-A1 SUBSTITUTED BETA,GAMMA-ANELLATED LACTONES BAYER AG (DE) 2000-11-02 EP disclosed
WO-1999036417-A1 SUBSTITUTED β,η-ANELLATED LACTONES BAYER AKTIENGESELLSCHAFT (DE) 1999-07-22 WO disclosed
US-4340732-A Butenolide herbicides and process for their preparation INTERNATIONAL DEVELOPMENT RESEARCH CENTRE OTTAWA ONTARIO CANADA K1G 3H9 A COORP OF CANADA (CA) 1982-07-20 US disclosed