SCHEMBL6068031

SCHEMBL6068031

C=C1C(C)=C(C)C(=O)C1(C)C

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.48

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
SCHEMBL11510351 0.69 CTSD (0.44) CTSD
SCHEMBL13760012 0.67
SCHEMBL18121638 0.65 CTSD (1.00) CTSD
SCHEMBL9915578 0.63
SCHEMBL11033379 0.61 DUSP3 (0.35) CTSD
SCHEMBL13209242 0.59 CTSD (0.31) CTSD
SCHEMBL1200227 0.59
SCHEMBL12317966 0.58 PTGES (0.36) CTSD
SCHEMBL11433337 0.57 MAPT (0.30)
SCHEMBL20245011 0.56 CTSD (0.37) CTSD

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
WO-2006105842-A1 SYNERGISTS FOR BOOSTING THE ACTION OF REPELLENTS MERCK PATENT GMBH (DE) 2006-10-12 WO disclosed