SCHEMBL20108598

SCHEMBL20108598

CCCCN(C)c1ccc(B2CC(C)(C)C(C)(C)O2)cc1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
LPL P06858 5/20 0.35
LIPG Q9Y5X9 5/20 0.35

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
SCHEMBL19074550 0.77 LMNA (0.35)
SCHEMBL20108584 0.76 MAPK1 (0.42) LPLLIPG
SCHEMBL23714871 0.75 LIPG (0.60) LPLLIPG
SCHEMBL21093667 0.74 LPL (0.58) LPLLIPG
SCHEMBL19673773 0.72 LIPG (0.47) LPLLIPG
SCHEMBL4130557 0.72 MAPT (0.66) MAPT
SCHEMBL20832231 0.70
SCHEMBL23635245 0.70 LPL (0.38) LPLLIPG
SCHEMBL21154235 0.70 LPL (0.49) LPLLIPG
SCHEMBL12031006 0.70 LPL (0.31) LPLLIPG

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-2964635-B1 ANTIVIRAL COMPOUNDS HOFFMANN LA ROCHE (CH) 2018-05-02 EP disclosed