SCHEMBL3834741

SCHEMBL3834741

CCCC(F)OC(=O)N(CCc1ccc(O)cc1)CC(=Cc1ccc(C(=O)O)cc1)COc1cccc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ P2RX3 P56373 2/20 0.37
▸ TSHR P16473 1/20 0.36
▸ MRGPRX4 Q96LA9 1/20 0.35
▸ LTB4R Q15722 4/20 0.35
▸ LTB4R2 Q9NPC1 4/20 0.35
▸ BCHE P06276 3/20 0.35
▸ DAPK1 P53355 1/20 0.35
▸ PIM3 Q86V86 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ GLI1 P08151 1/20 0.33

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
SCHEMBL3832337 0.94 LPAR1 (0.40) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL3834922 0.89 P2RX3 (0.39) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL1306418 0.85 MAPT (0.41) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL1306412 0.85 MAPT (0.41) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL1306415 0.85 MAPT (0.41) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL3832922 0.83 P2RX3 (0.38) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL3826815 0.83 TRPM8 (0.38) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL3832634 0.81 L3MBTL1 (0.38) KMT2AP2RX3TSHRALDH1A1KDM4E
SCHEMBL1308690 0.79 LPAR1 (0.43) MEN1MAPTKMT2APOLBMAPK1
SCHEMBL1308692 0.79 LPAR1 (0.43) MEN1MAPTKMT2APOLBMAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2089354-A1 NAPHTHALENYLOXYPROPENYL DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Korea Research Institute Of Chemical Technology (KR) 2009-08-19 — — EP disclosed
WO-2008054154-A1 NAPHTHALENYLOXYPROPENYL DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-05-08 — — WO disclosed
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