SCHEMBL4641983

SCHEMBL4641983

O=C(CCCO)C(=O)Cc1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
LMNA P02545 3/20 0.43
CTBP2 P56545 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
ESR2 Q92731 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 1/20 0.40
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
HTT P42858 2/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL4642091 0.95 GAA (0.43) GAAEGFRERBB2LMNACTBP2
SCHEMBL4644565 0.89 GAA (0.47) GAAEGFRERBB2LMNACTBP2
SCHEMBL4643975 0.84 GAA (0.43) GAAEGFRERBB2LMNACTBP2
SCHEMBL27620007 0.82 LMNA (0.45) GAAEGFRERBB2LMNACTBP2
SCHEMBL4644481 0.82 GAA (0.42) GAAEGFRERBB2LMNACTBP2
SCHEMBL4642197 0.81 L3MBTL1 (0.46) EGFRERBB2LMNACTBP2CES2
SCHEMBL4641942 0.81 CES1 (0.68) CES2CES1TDP1SMN1; SMN2ALDH1A1
SCHEMBL4641892 0.80 GAA (0.50) GAAEGFRERBB2LMNACTBP2
SCHEMBL4645956 0.79 GAA (0.50) GAAEGFRERBB2LMNACTBP2
SCHEMBL4642078 0.77 HTT (0.53) CTBP2NPC1POLBSMN1; SMN2ALDH1A1

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