SCHEMBL4643585

SCHEMBL4643585

[CH2]CCCC(=O)Oc1cc(OCC)cc(OCC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PTGS2 P35354 1/20 0.38
SLC22A2 O15244 1/20 0.37
TMPRSS2 O15393 1/20 0.37
F2 P00734 1/20 0.37
F10 P00742 1/20 0.37
PLG P00747 1/20 0.37
F12 P00748 1/20 0.37
PLAU P00749 1/20 0.37
PLAT P00750 1/20 0.37
KLKB1 P03952 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL4645362 0.91 KMT2A (0.41) NPC1KMT2AMEN1HTTALDH1A1
SCHEMBL4647638 0.86 KMT2A (0.54) NPC1KMT2AMEN1L3MBTL1HTT
SCHEMBL4645092 0.86 NPC1 (0.41) NPC1KMT2AMEN1L3MBTL1HTT
SCHEMBL4644120 0.86 NPC1 (0.41) NPC1KMT2AMEN1L3MBTL1HTT
SCHEMBL4644551 0.85 KMT2A (0.40) NPC1KMT2AMEN1L3MBTL1HTT
SCHEMBL4641904 0.85 KMT2A (0.40) NPC1KMT2AMEN1L3MBTL1HTT
SCHEMBL4642148 0.84 PTGS2 (0.41) NPC1KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL27619990 0.83 NPC1 (0.42) NPC1KMT2AMEN1L3MBTL1HTT
SCHEMBL4646323 0.82 KMT2A (0.42) NPC1KMT2AMEN1HTTALDH1A1
SCHEMBL4641756 0.81 TOP2A (0.47) NPC1KMT2AMEN1HTTALDH1A1

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