SCHEMBL1306695

SCHEMBL1306695

COCC(C)NC(=O)C(=Cc1ccc(C(=O)O)c(C)c1)COc1cccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TRPM4 Q8TD43 1/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ POLB P06746 3/20 0.40
▸ G6PD P11413 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ DAPK1 P53355 1/20 0.38
▸ PIM3 Q86V86 1/20 0.38
▸ CASP3 P42574 2/20 0.37
▸ OGG1 O15527 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ CASP8 Q14790 1/20 0.36
▸ AKR1C2 P52895 1/20 0.36
▸ CASP1 P29466 1/20 0.36

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
SCHEMBL1306564 0.88 KMT2A (0.50) KMT2AMEN1POLBKDM4EALDH1A1
SCHEMBL1306569 0.88 KMT2A (0.50) KMT2AMEN1POLBKDM4EALDH1A1
SCHEMBL1306803 0.86 HPGD (0.43) TRPM4KMT2AMEN1POLBG6PD
SCHEMBL1306692 0.85 KMT2A (0.47) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL1305939 0.83 MEN1 (0.46) KMT2AMEN1POLBKDM4EALDH1A1
SCHEMBL1305934 0.83 MEN1 (0.46) KMT2AMEN1POLBKDM4EALDH1A1
SCHEMBL1326044 0.81 TRPM4 (0.41) TRPM4KMT2AMEN1POLBG6PD
SCHEMBL1306823 0.80 TRPM4 (0.38) TRPM4KMT2AMEN1POLBG6PD
SCHEMBL1306160 0.79 KMT2A (0.45) TRPM4KMT2AMEN1POLBG6PD
SCHEMBL1325518 0.79 TRPM4 (0.41) TRPM4KMT2AMEN1POLBG6PD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8053435-B2 Naphthalenyloxypropenyl derivatives having inhibitory activity against histone deacetylase and pharmaceutical composition comprising the same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2011-11-08 — — US disclosed
Send feedback