SCHEMBL2304840

SCHEMBL2304840

CCCC#CC1=CCCC1=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.30

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
SCHEMBL8566623 0.66
SCHEMBL23706686 0.65
SCHEMBL1238217 0.64 CYP1A2 (0.42) CYP1A2
SCHEMBL1044406 0.63
SCHEMBL2304844 0.61 GSTP1 (0.31)
SCHEMBL11902985 0.61 MAPT (0.33) CYP1A2
SCHEMBL1340149 0.61
SCHEMBL2301582 0.60 GABRP (0.31)
SCHEMBL6897537 0.60 GSTP1 (0.30)
SCHEMBL1150883 0.60 ACHE (0.36)

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-2011101757-A1 CYCLIC OXY COMPOUNDS AS PERFUMING INGREDIENTS FIRMENICH SA (CH) 2011-08-25 WO disclosed