SCHEMBL4428965

SCHEMBL4428965

CC1(C)CC1=O

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
SCHEMBL15658450 0.80
SCHEMBL15659057 0.78
SCHEMBL13618063 0.75
SCHEMBL14551251 0.74 NPSR1 (0.35)
SCHEMBL14278445 0.73 NPSR1 (0.34)
SCHEMBL2612037 0.73
SCHEMBL2690654 0.72
SCHEMBL5677407 0.71
SCHEMBL957525 0.71 NPSR1 (0.33)
SCHEMBL1058536 0.70 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3260847-A2 TEST CONTAINER FOR TESTING INSPECTION UNITS Krones AG (DE) 2017-12-27 EP claimed
EP-2986973-B1 TEST CONTAINER FOR TESTING INSPECTION DEVICES KRONES AG (DE) 2017-08-02 EP claimed
CN-116406259-A Dosage form compositions comprising inhibitors of BTK and mutants thereof 广州麓鹏制药有限公司 2023-07-07 CN disclosed
EP-2735581-B1 COMPOSITION AND POLYMER ASAHI CHEMICAL IND (JP) 2021-07-14 EP disclosed
EP-3546055-B1 METHOD AND SYSTEM FOR DECOMPOSING A FLUOROKETONE INTO DISPOSABLE DECOMPOSITION PRODUCTS ABB SCHWEIZ AG (CH) 2021-01-13 EP disclosed
EP-3167464-B1 ELECTRICAL DEVICE COMPRISING A GAS-INSULATED APPARATUS, IN PARTICULAR A GAS-INSULATED TRANSFORMER OR REACTOR ABB POWER GRIDS SWITZERLAND AG (CH) 2020-06-17 EP disclosed
EP-3614401-A1 METHOD FOR RECLAIMING AT LEAST ONE SUBSTANCE FROM AN INSULATION MEDIUM OF AN ELECTRICAL APPARATUS FOR THE GENERATION, TRANSMISSION, DISTRIBUTION AND/OR USAGE OF ELECTRICAL ENERGY ABB Schweiz AG (CH) 2020-02-26 EP disclosed
EP-3546055-A1 METHOD FOR DECOMPOSING A FLUOROKETONE INTO DISPOSABLE DECOMPOSITION PRODUCTS ABB Schweiz AG (CH) 2019-10-02 EP disclosed
CN-105754099-B Composition and polymer 旭化成株式会社 2018-09-18 CN disclosed
US-20180005727-A1 APPARATUS CONTAINING A DIELECTRIC INSULATION GAS COMPRISING AN ORGANOFLUORINE COMPOUND ABB SCHWEIZ AG (CH) 2018-01-04 US disclosed
US-20170287588-A1 APPARATUS FOR THE GENERATION, DISTRIBUTION AND/OR USAGE OF ELECTRICAL ENERGY AND COMPONENT FOR SUCH AN APPARATUS HITACHI ENERGY LTD (CH) 2017-10-05 US disclosed
US-20040258781-A1 Cyclooxygenase-2 inhibitory withanolide compositions and method BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2004-12-23 US disclosed
WO-2004043478-A1 CYCLOOXYGENASE-2 INHIBITORY WITHANOLIDE COMPOSITIONS AND METHOD MICHIGAN STATE UNIVERSITY (US) 2004-05-27 WO disclosed
US-20040096524-A1 Cyclooxygenase-2 inhibitory withanolide compositions and method MICHIGAN STATE UNIVERSITY (US) 2004-05-20 US disclosed
EP-0269514-B1 DERIVATIVES OF 2,2-DIMETHYLCYCLOPROPANECARBOXYLIC ACID BEARING A SATURATED HALOGENATED CHAIN AT C-3, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE AS PESTICIDES AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1992-08-26 EP disclosed
EP-0296488-B1 METHOD FOR THE PRODUCTION OF UNSATURATED AND SATURATED KETONES BASF Aktiengesellschaft (DE) 1991-11-27 EP disclosed
EP-0451873-A1 Derivatives of 2,2-dimethyl cyclopropanecarboxylic acid substituted at c-3 by a saturated halogenated chain, process for their preparation and their use in the synthesis of pesticidal products ROUSSEL-UCLAF (FR) 1991-10-16 EP disclosed
EP-0445843-A2 Process for the preparation of cyclopropanecarboxylic acid derivatives substituted at position 3 by a saturated halogenated chain ROUSSEL-UCLAF (FR) 1991-09-11 EP disclosed
EP-0296488-A2 Method for the production of unsaturated and saturated ketones BASF Aktiengesellschaft (DE) 1988-12-28 EP disclosed
EP-0269514-A2 Derivatives of 2,2-dimethylcyclopropanecarboxylic acid bearing a saturated halogenated chain at C-3, process and intermediates for their preparation, their use as pesticides and compositions containing them ROUSSEL-UCLAF (FR) 1988-06-01 EP disclosed