SCHEMBL4644498

SCHEMBL4644498

CC(C)(C)CC(=O)C(=O)CCCCCl

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CES2 O00748 5/20 0.41
CES1 P23141 5/20 0.41
FAAH O00519 1/20 0.32

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
SCHEMBL4643992 0.93 CES1 (0.39) CES2CES1
SCHEMBL4644054 0.84 CES2 (0.33) CES2CES1
SCHEMBL4645784 0.80 CES1 (0.42) CES2CES1
SCHEMBL27601407 0.78 ALDH1A1 (0.44) CES2CES1
SCHEMBL4645363 0.77 CES1 (0.40) CES2CES1
SCHEMBL4647229 0.76 CES1 (0.37) CES2CES1FAAH
SCHEMBL14914212 0.75 HMGCR (0.40) CES2CES1
SCHEMBL4644423 0.74 CES2 (0.43) CES2CES1FAAH
SCHEMBL4643406 0.74 TSHR (0.33)
SCHEMBL16940468 0.72 CES1 (0.63) CES2CES1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed