SCHEMBL6419752

SCHEMBL6419752

CC(C)CCC#CC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 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
SCHEMBL23660488 0.80 OPRM1 (0.32)
SCHEMBL21846908 0.80
SCHEMBL10710668 0.76 LMNA (0.35) LMNA
SCHEMBL4533971 0.75
SCHEMBL4567343 0.73 ACHE (0.31)
SCHEMBL31295849 0.72 LMNA (0.33) LMNA
SCHEMBL28220323 0.72
SCHEMBL8960831 0.72 LMNA (0.35) LMNA
SCHEMBL4595867 0.71 CA1 (0.33) LMNA
SCHEMBL9547934 0.69 GRIK1 (0.32) LMNA

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
US-20050287594-A1 Activity-based probes having specificity to the active form of enzymes and receptors; screening for desired biological activities or target proteins SCRIPPS RESEARCH INSTITUTE, THE 2005-12-29 US disclosed