SCHEMBL8572483

SCHEMBL8572483

CC(C)C(O)=S.[NaH]

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
SCHEMBL873801 0.95
SCHEMBL28291388 0.91
Hydrochloric Acid SCHEMBL8686366 0.91
Hydrochloric Acid SCHEMBL18189712 0.91 ALDH1A1 (0.31)
SCHEMBL28492986 0.87
SCHEMBL3731421 0.78
SCHEMBL2307969 0.78
SCHEMBL11106192 0.78 FFAR3 (0.32)
Ethane SCHEMBL11430474 0.75
Ethane SCHEMBL10960831 0.75 FFAR3 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308145-A2 Mylbemycin derivatives with antiparasitic activity Pfizer Limited (GB) 1989-03-22 EP claimed
US-5840704-A INSECTICIDES, MITICIDES, ANTHELMINTICS PFIZER INC. (US) 1998-11-24 US disclosed
US-5451511-A Biosynthesis, avermectins PFIZER INC. (US) 1995-09-19 US disclosed
US-5089480-A ANTIPARASITIC AGENTS PFIZER INC. (US) 1992-02-18 US disclosed
US-5026643-A On carboxylic acid substrate PFIZER INC. (US) 1991-06-25 US disclosed
US-4929638-A INSECTICIDES, ANTHELMINTICS PFIZER INC. (US) 1990-05-29 US disclosed
US-4927847-A PARASITICIDES PFIZER INC. (US) 1990-05-22 US disclosed
EP-0308145-A2 Mylbemycin derivatives with antiparasitic activity Pfizer Limited (GB) 1989-03-22 EP disclosed
EP-0214731-A2 Antiparasitic avermectin and milbemycin derivatives and process for their preparation Pfizer Limited (GB) 1987-03-18 EP disclosed