SCHEMBL5960264

SCHEMBL5960264

C#CCN(CCCCI)C(=O)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
SCHEMBL9423831 0.98 KDM4E (0.31)
SCHEMBL537444 0.78 CA12 (0.45)
SCHEMBL4621524 0.76 PYCR1 (0.35)
SCHEMBL22129668 0.70 MAOB (0.30)
SCHEMBL309219 0.70
SCHEMBL5710568 0.69
SCHEMBL20263531 0.68
SCHEMBL28743237 0.68
SCHEMBL1022097 0.67 CHRM1 (0.31)
SCHEMBL10780245 0.67 ZDHHC20 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2922397-B1 PRESERVATIVES EDEN RESEARCH PLC (GB) 2020-12-30 EP disclosed
US-10383329-B2 Preservatives EDEN RESEARCH PLC (GB) 2019-08-20 US disclosed
US-20150289503-A1 Preservatives EDEN RESEARCH PLC (GB) 2015-10-15 US disclosed
EP-2922397-A2 PRESERVATIVES EDEN RESEARCH PLC (GB) 2015-09-30 EP disclosed
WO-2014080199-A2 PRESERVATIVES EDEN RESEARCH PLC (GB) 2014-05-30 WO disclosed
EP-1706529-A1 FABRIC ARTICLE TREATING DEVICE AND FABRIC ARTICLE TREATING SYSTEM WITH ANTI-MICROBIAL AGENT The Procter and Gamble Company (US) 2006-10-04 EP disclosed
WO-2005073451-A1 FABRIC ARTICLE TREATING DEVICE AND FABRIC ARTICLE TREATING SYSTEM WITH ANTI-MICROBIAL AGENT THE PROCTER & GAMBLE COMPANY (US) 2005-08-11 WO disclosed
US-20050076532-A1 Fabric article treating device and system with anti-microbial agent PROCTER & GAMBLE COMPANY, THE 2005-04-14 US disclosed
EP-1252221-A2 ANTIBACTERIAL MICROPOROUS FILM AND METHOD OF MAKING CLOPAY PLASTIC PRODUCTS COMPANY, INC. (US) 2002-10-30 EP disclosed
WO-2001051548-A2 ANTIBACTERIAL MICROPOROUS FILM AND METHOD OF MAKING CLOPAY PLASTIC PRODUCTS COMPANY, INC. (US) 2001-07-19 WO disclosed
US-6005032-A PROTECTION OF THERMOP;ASTIC RESINS WITH FUNGICIDES ZENECA LIMITED (GB) 1999-12-21 US disclosed
EP-0804078-B1 COMPOSITION AND USE ZENECA LTD (GB) 1999-11-10 EP disclosed
US-5965150-A CAPSULE SHELL OF WATER SOLUBLE POLYOXYETHYLENE, PLASTICIZER, OPTIONAL ADDITIVES AND FILLING OF INSECTICIDE OR NEMATOCIDE INSERTED INTO PLANT NIHON BAYER AGROCHEM K.K. (JP) 1999-10-12 US disclosed
US-5354777-A Cyanoalkene derivatives, process for their preparation, and their use as microbicide for the protection of materials BAYER AKTIENGESELLSCHAFT (DE) 1994-10-11 US disclosed
US-5326777-A Fungicides for plastics BAYER AKTIENGESELLSCHAFT (DE) 1994-07-05 US disclosed