SCHEMBL3712166

SCHEMBL3712166

CCOC1C(OC)C(C)OC(O)C1OC

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
SCHEMBL13224277 1.00
SCHEMBL3463369 1.00
SCHEMBL6757839 0.87
SCHEMBL4549511 0.86
SCHEMBL18755348 0.86
SCHEMBL19244929 0.86
SCHEMBL18755347 0.86
SCHEMBL14049449 0.85
SCHEMBL4549446 0.85 GBA1 (0.35)
SCHEMBL16114046 0.85 GBA1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4003966-A1 5-AMINO SUBSTITUTED PYRAZOLES AND TRIAZOLES AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2022-06-01 EP disclosed
EP-2396338-A1 PESTICIDAL COMPOSITIONS Dow AgroSciences LLC (US) 2011-12-21 EP disclosed
WO-2010093764-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2010-08-19 WO disclosed