SCHEMBL7597193

SCHEMBL7597193

CC(C)([NH])C#N

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
SCHEMBL3296841 0.78
SCHEMBL3827613 0.73
SCHEMBL47739 0.70
SCHEMBL5719204 0.70
SCHEMBL10449726 0.68
SCHEMBL6591622 0.67
SCHEMBL66166 0.67
SCHEMBL576290 0.67 ALDH1A1 (0.36)
SCHEMBL262158 0.67
SCHEMBL14394409 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976760-B1 Oligopeptides with fungicidal activity ISAGRO SPA (IT) 2002-12-18 EP claimed
US-6084065-A FOR AGRICULTURAL USE ISAGRO SPA (IT) 2000-07-04 US claimed
EP-0652229-B1 Oligopeptides with fungicidal activity ISAGRO SPA (IT) 2000-05-24 EP claimed
EP-0976760-A2 Oligopeptides with fungicidal activity ISAGRO S.p.A. (IT) 2000-02-02 EP claimed
EP-0652229-A2 Oligopeptides with fungicidal activity ISAGRO S.p.A. (IT) 1995-05-10 EP claimed
EP-0223449-B1 METHOD OF WEED CONTROL USING DIFLUFENICAN MAY & BAKER LIMITED (GB) 1991-07-24 EP claimed
US-4767757-A Acyloxythiophene-carboxamide fungicides, compositions and use BAYER AKTIENGESELLSCHAFT (DE) 1988-08-30 US claimed
EP-0241735-A2 Acyloxythiophene carbon amide BAYER AG (DE) 1987-10-21 EP claimed
US-RE31136-E Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1983-02-01 US claimed
US-4092150-A Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1978-05-30 US claimed
EP-0976760-B1 Oligopeptides with fungicidal activity ISAGRO SPA (IT) 2002-12-18 EP disclosed
US-20020137750-A1 Amidine derivatives which are inhibitors of nitric oxide synthase ASTRAZENECA AB (SE) 2002-09-26 US disclosed
US-6084065-A FOR AGRICULTURAL USE ISAGRO SPA (IT) 2000-07-04 US disclosed
EP-0652229-B1 Oligopeptides with fungicidal activity ISAGRO SPA (IT) 2000-05-24 EP disclosed
EP-0652229-A2 Oligopeptides with fungicidal activity ISAGRO S.p.A. (IT) 1995-05-10 EP disclosed
US-RE31136-E Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1983-02-01 US disclosed
US-4339237-A Free amine-containing polymeric dyes DYNAPOL (US) 1982-07-13 US disclosed
US-4144252-A ANTHRAQUINONE DYES DYNAPOL (US) 1979-03-13 US disclosed
US-4092150-A Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1978-05-30 US disclosed
US-4051138-A Water-soluble amine-linked polymeric colorants DYNAPOL (US) 1977-09-27 US disclosed