SCHEMBL6969940

SCHEMBL6969940

C=CCCOC([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
SCHEMBL9543088 0.85
SCHEMBL47886 0.83 CA2 (0.42)
SCHEMBL9541449 0.83 LPAR3 (0.48)
SCHEMBL47887 0.79
SCHEMBL6723047 0.79
SCHEMBL30584 0.77
SCHEMBL506184 0.77
SCHEMBL20954170 0.77 ATM (0.48)
SCHEMBL10917794 0.77 ATM (0.48)
SCHEMBL347510 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4371979-A1 FORMAMIDE DERIVATIVE AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT Kumiai Chemical Industry Co., Ltd. (JP) 2024-05-22 EP disclosed
WO-2023286855-A1 FORMAMIDE DERIVATIVE AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT クミアイ化学工業株式会社 2023-01-19 WO disclosed
EP-2540719-B1 CYCLIC AMINE COMPOUND AND ACARICIDE NIPPON SODA CO (JP) 2015-10-07 EP disclosed
US-8980912-B2 Cyclic amine compound and acaricide NIPPON SODA CO., LTD. (JP) 2015-03-17 US disclosed
EP-2540719-A1 CYCLIC AMINE COMPOUND AND MITICIDE Nippon Soda Co., Ltd. (JP) 2013-01-02 EP disclosed
US-20120309964-A1 CYCLIC AMINE COMPOUND AND ACARICIDE NIPPON SODA CO., LTD 2012-12-06 US disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
WO-1993011669-A1 USE OF 3-PHENYLURACIL DERIVATIVES FOR THE DESICCATION AND ABSCISSION OF PLANT PARTS BASF AKTIENGESELLSCHAFT (DE) 1993-06-24 WO disclosed