SCHEMBL4642634

SCHEMBL4642634

CC(=O)OCC(=O)C(=O)CCCCl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.36
CES2 O00748 5/20 0.36
ALDH1A1 P00352 5/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
FAAH O00519 1/20 0.34
GALR3 O60755 1/20 0.31
PKM P14618 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PGR P06401 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
HTR1A P08908 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRM3 P20309 1/20 0.30
TBXA2R P21731 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 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
SCHEMBL4645800 0.94 CES1 (0.38) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL4641669 0.87 ALDH1A1 (0.39) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL27619996 0.82 ALDH1A1 (0.41) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL4645324 0.81 CES1 (0.37) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL4647836 0.79 CES1 (0.36) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL4644197 0.79 CES1 (0.39) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL4645775 0.78 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10FAAHGALR3
SCHEMBL4645325 0.76 ALDH1A1 (0.40) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL4642469 0.74 ALDH1A1 (0.39) CES1CES2ALDH1A1LMNAHSD17B10
SCHEMBL4645361 0.70 ALDH1A1 (0.43) ALDH1A1LMNAHSD17B10FAAHGALR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN 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