SCHEMBL4644545

SCHEMBL4644545

CC[CH]C(=O)OC(=O)COc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.50
AOC2 O75106 2/20 0.45
MAOA P21397 2/20 0.45
MAOB P27338 2/20 0.45
DAO P14920 1/20 0.45
MAPT P10636 2/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
RECQL P46063 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
AOC3 Q16853 1/20 0.41

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
SCHEMBL4643925 0.88 ALOX15 (0.47) ALOX15AOC2MAOAMAOBDAO
SCHEMBL4642322 0.86 MAPT (0.47) AOC2MAOAMAOBDAOMAPT
SCHEMBL4645267 0.83 ALOX15 (0.53) ALOX15AOC2MAOAMAOBDAO
SCHEMBL9602821 0.81 ALOX15 (0.59) ALOX15MAPTMEN1KMT2AALDH1A1
SCHEMBL264346 0.80 ALOX15 (0.68) ALOX15MAPTMEN1KMT2AALDH1A1
SCHEMBL4646684 0.78 MAPT (0.44) MAPTALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL264347 0.78 ALOX15 (0.59) ALOX15MAPTMEN1KMT2AALDH1A1
SCHEMBL5612980 0.77 ZDHHC2 (0.46) ALOX15MAPTKMT2AALDH1A1RAB9A
SCHEMBL27718339 0.77 ALOX15 (0.63) ALOX15MAPTMEN1KMT2AALDH1A1
SCHEMBL4644518 0.77 TSHR (0.50) MEN1KMT2AALDH1A1SMN1; SMN2

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