SCHEMBL25022548

SCHEMBL25022548

CCC(=O)OC(C)CC1CCC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 12/20 0.54
▸ CTSL P07711 7/20 0.54
▸ CTSB P07858 7/20 0.54
▸ CTSH P09668 5/20 0.46
▸ CHRM2 P08172 2/20 0.37
▸ CHRM4 P08173 2/20 0.37
▸ CHRM1 P11229 2/20 0.37
▸ CHRM3 P20309 2/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL25021345 0.96 CTSK (0.57) CTSKCTSLCTSBCTSH
SCHEMBL1227603 0.95 CTSK (0.60) CTSKCTSLCTSBCTSH
SCHEMBL25022434 0.92 CTSK (0.49) CTSKCTSLCTSBCTSHCHRM2
SCHEMBL19569610 0.74 CTSK (0.56) CTSKCTSLCTSBCTSH
SCHEMBL16746653 0.71 CTSK (0.50) CTSKCTSLCTSBCTSH
SCHEMBL2179628 0.71 CTSK (0.45) CTSKCTSLCTSBCTSH
SCHEMBL14784713 0.71 LMNA (0.48) CTSKCTSLCTSBCTSHCHRM2
SCHEMBL1585397 0.71 — —
SCHEMBL2984973 0.71 — —
SCHEMBL2982775 0.71 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3565410-B1 PICOLINAMIDES AS FUNGICIDES CORTEVA AGRISCIENCE LLC (US) 2023-02-15 — — EP disclosed
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