SCHEMBL4642124

SCHEMBL4642124

O=C(CCCCO)C(=O)Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.65
CES2 O00748 2/20 0.65
FNTA P49354 2/20 0.55
FNTB P49356 2/20 0.55
AKR1B1 P15121 1/20 0.48
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
PLAAT3 P53816 1/20 0.44
PLAAT5 Q96KN8 1/20 0.44
PLAAT2 Q9NWW9 1/20 0.44
PLAAT4 Q9UL19 1/20 0.44
HDAC8 Q9BY41 3/20 0.43
HDAC6 Q9UBN7 3/20 0.43
HDAC3 O15379 2/20 0.43
HDAC4 P56524 2/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC7 Q8WUI4 2/20 0.43
HDAC2 Q92769 2/20 0.43
HDAC10 Q969S8 2/20 0.43
HDAC11 Q96DB2 2/20 0.43

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
SCHEMBL4641942 0.94 CES1 (0.68) CES1CES2FNTAFNTBAKR1B1
SCHEMBL4643571 0.86 CES1 (0.74) CES1CES2FNTAFNTBAKR1B1
SCHEMBL4644022 0.83 CES2 (0.63) CES1CES2FNTAFNTBAKR1B1
SCHEMBL789389 0.82 TDP1 (0.51) CES1CES2FNTAFNTBAKR1B1
SCHEMBL4642091 0.81 GAA (0.43) CES1CES2FNTAFNTBHDAC8
SCHEMBL28143905 0.81 MEN1 (0.64) CES1CES2FNTAFNTBMEN1
SCHEMBL4642061 0.81 L3MBTL1 (0.45) CES1CES2FNTAFNTBMAPT
SCHEMBL574185 0.81 CES1 (1.00) CES1CES2FNTAFNTBAKR1B1
SCHEMBL4644050 0.81 CES1 (0.65) CES1CES2FNTAFNTBAKR1B1
SCHEMBL8214389 0.81 L3MBTL1 (0.50) CES1CES2AKR1B1MAPTRXFP1

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