SCHEMBL4643582

SCHEMBL4643582

CCC[CH]C(=O)Oc1cc(OCC)cc(OCC)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.39
PARP10 Q53GL7 1/20 0.37
PLA2G2A P14555 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NQO1 P15559 1/20 0.35
LMNA P02545 3/20 0.35
NPC1 O15118 1/20 0.35
PLK1 P53350 1/20 0.35
POLB P06746 1/20 0.35
CYP1A2 P05177 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PAX8 Q06710 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL4647636 0.86 NQO1 (0.50) PARP10ALDH1A1MEN1KMT2ANQO1
SCHEMBL4645356 0.85 PTGS2 (0.41) PTGS2PARP10KDM4EALDH1A1SMN1; SMN2
SCHEMBL4643737 0.80 MEN1 (0.44) PTGS2ALDH1A1MEN1KMT2ATDP1
SCHEMBL4642145 0.79 PTGS2 (0.41) PTGS2PARP10KDM4EALDH1A1SMN1; SMN2
SCHEMBL6247098 0.74 ZDHHC2 (0.48) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL4642186 0.73 THRB (0.45) SMN1; SMN2MEN1KMT2ALMNACYP1A2
SCHEMBL4645333 0.73 THRB (0.45) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL4642531 0.72 PTGS2 (0.41) PTGS2PARP10KDM4EALDH1A1MEN1
SCHEMBL4646065 0.71 MGLL (0.49) MEN1KMT2ALMNACYP1A2MAPK1
SCHEMBL4644818 0.71 CYP3A4 (0.57) MEN1KMT2ALMNAPOLB

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