SCHEMBL23398447

SCHEMBL23398447

CC(C)Cc1[nH]n(C(C)(C)C)c(=O)c1C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL23400038 0.81 GAA (0.33) LMNAMAPTHTTSMN1; SMN2
SCHEMBL23400283 0.81 LMNA (0.31) LMNAMAPTHTTSMN1; SMN2
SCHEMBL23401783 0.81 PDE2A (0.30) —
SCHEMBL23402783 0.80 GAA (0.32) —
SCHEMBL23403415 0.79 — —
SCHEMBL23399279 0.78 LMNA (0.30) LMNAMAPTHTTSMN1; SMN2
SCHEMBL23400290 0.78 MEN1 (0.34) MAPTHTTSMN1; SMN2
SCHEMBL23399157 0.77 GAA (0.30) —
SCHEMBL23403343 0.76 — —
SCHEMBL23400528 0.75 LMNA (0.30) LMNAMAPTHTTSMN1; SMN2

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 — — EP disclosed
Send feedback