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
SCHEMBL6018785 0.87 — —
SCHEMBL235988 0.87 — —
SCHEMBL11287673 0.86 — —
SCHEMBL6814524 0.86 PLG (0.44) —
SCHEMBL927909 0.86 ESR1 (0.34) —
SCHEMBL8792393 0.86 ALDH1A1 (0.32) —
SCHEMBL926635 0.86 — —
SCHEMBL6814518 0.86 PLG (0.44) —
SCHEMBL3427792 0.86 ESR1 (0.34) —
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
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