SCHEMBL402037

SCHEMBL402037

C#CCC1CC1

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
SCHEMBL235988 0.87
SCHEMBL6018785 0.87
SCHEMBL6814524 0.86 PLG (0.44)
SCHEMBL11287673 0.86
SCHEMBL3427792 0.86 ESR1 (0.34)
SCHEMBL6814518 0.86 PLG (0.44)
SCHEMBL927909 0.86 ESR1 (0.34)
SCHEMBL8792393 0.86 ALDH1A1 (0.32)
SCHEMBL926635 0.86
SCHEMBL11396333 0.84 CHRM5 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3750894-B1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2024-04-03 EP claimed
EP-3901147-B1 ACYLAMINO BRIDGED HETEROCYCLIC COMPOUND, AND COMPOSITION AND APPLICATION THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2023-11-22 EP claimed
EP-3750893-B1 DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2023-04-19 EP claimed
EP-3228616-B1 PYRIDINE DERIVATIVES ASTELLAS PHARMA INC (JP) 2019-10-16 EP claimed
EP-2855474-B1 N-THIO-ANTHRANILAMIDE COMPOUNDS AND THEIR USE AS PESTICIDES BASF SE (DE) 2017-10-18 EP claimed
EP-2978317-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS Syngenta Participations AG (CH) 2016-02-03 EP claimed
WO-2014154486-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 WO claimed
EP-1790639-B1 SPIROCYCLIC COMPOUNDS AND THEIR USE AS CXCR4-ANTAGONISTS ONO PHARMACEUTICAL CO (JP) 2014-03-26 EP claimed
EP-2582777-A1 FUEL COMPOSITION AND ITS USE Shell Oil Company (US) 2013-04-24 EP claimed
WO-2011163122-A1 FUEL COMPOSITION AND ITS USE SHELL OIL COMPANY (US) 2011-12-29 WO claimed
EP-0828721-B1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS SEARLE & CO (US) 2001-11-14 EP claimed
EP-0512349-B1 Benzothiophene-2-carboxamide-S,S-dioxides BAYER AG (DE) 1996-02-14 EP claimed
EP-0397427-B1 Fluoro-amide derivatives having human leucocyte elastase inhibiting activity ZENECA INC (US) 1994-05-04 EP claimed
EP-0355544-B1 Substituted decalin amines, method for their preparation and their use in pesticides BAYER AG (DE) 1994-01-26 EP claimed
EP-0355597-B1 SUBSTITUTED DIOXOLANYLETHYLAMINES, PROCESS FOR THEIR PREPARATION, THEIR USE IN PESTICIDES, AND INTERMEDIATES BAYER AG (DE) 1993-06-09 EP claimed
EP-0289913-B1 PARASITICIDAL AGENT BASED ON SUBSTITUTED AMINOMETHYL HETEROCYCLES BAYER AG (DE) 1993-01-13 EP claimed
EP-0359979-B1 AMINOMETHYLHETEROCYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, THEIR USE IN PESTICIDES, AND INTERMEDIATES BAYER AG (DE) 1992-12-30 EP claimed
EP-0281842-B1 AMINOMETHYL-HETEROCYCLES BAYER AG (DE) 1991-07-17 EP claimed
EP-0278352-B1 AMINOMETHYL-TETRAHYDRO-FURANES BAYER AG (DE) 1991-04-10 EP claimed
EP-0278311-B1 2-AMINOMETHYL TETRAHYDROFURANES BAYER AG (DE) 1990-07-18 EP claimed