SCHEMBL3931271

SCHEMBL3931271

CCCCCCCCCCCCCCC(C)(CC)C(=O)C=O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.40
GGPS1 O95749 6/20 0.38
FDPS P14324 9/20 0.37
SMPD1 P17405 2/20 0.36
LPAR1 Q92633 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36

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
SCHEMBL26463847 0.92 CES2 (0.42) CES2GGPS1FDPSSMPD1LPAR1
SCHEMBL26464234 0.92 CES2 (0.42) CES2GGPS1FDPSSMPD1LPAR1
SCHEMBL26465126 0.90 CES2 (0.39) CES2GGPS1FDPS
SCHEMBL18857378 0.83 ZDHHC20 (0.42) CES2GGPS1FDPS
SCHEMBL25623007 0.80 CES2 (0.37) CES2GGPS1FDPSSMPD1LPAR1
SCHEMBL20982157 0.80 HCAR2 (0.45)
SCHEMBL25122268 0.79 CES2 (0.39) CES2GGPS1FDPS
SCHEMBL18867031 0.79 CES2 (0.40) CES2GGPS1LPAR1LPAR3
SCHEMBL18999588 0.79 CES2 (0.40) CES2GGPS1LPAR1LPAR3
SCHEMBL20936468 0.78 CES2 (0.44) CES2GGPS1

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-1555878-B1 COPPER COMPLEXES AND THEIR USE AS WOOD PRESERVATIVES DU PONT (US) 2009-04-08 EP claimed