SCHEMBL4604318

SCHEMBL4604318

COc1ccc(C(=O)[C@@H](C)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
POLB P06746 2/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
CES2 O00748 2/20 0.58
CES1 P23141 2/20 0.58
NPSR1 Q6W5P4 1/20 0.57
ALDH1A1 P00352 5/20 0.55
LMNA P02545 3/20 0.55
MITF O75030 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HIF1A Q16665 1/20 0.55
CYP1A2 P05177 1/20 0.54
GPR88 Q9GZN0 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
ACP3 P15309 1/20 0.51

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
SCHEMBL4604321 1.00 MAPT (0.61) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL1755267 0.93 L3MBTL1 (0.58) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL16162246 0.91 MEN1 (0.58) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL18998439 0.85 TDP1 (0.56) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL7512700 0.85 MAPT (0.64) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL5217880 0.84 MAPT (0.63) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL7560417 0.84 L3MBTL1 (0.66) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL16162350 0.83 ALDH1A1 (0.55) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL16162796 0.83 ALDH1A1 (0.55) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL13461622 0.83 MEN1 (0.51) MAPTPOLBNPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650286-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed
US-7108895-B2 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEMICAL CO., LTD. (JP) 2006-09-19 US disclosed
EP-1650284-A2 Liquid crystal composition containing an optical active compound and liquid crystal electro-optical element Seimi Chemical Co., Ltd. (JP) 2006-04-26 EP disclosed
EP-1650285-A2 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element Seimi Chemical Co., Ltd. (JP) 2006-04-26 EP disclosed
EP-1650286-A2 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element Seimi Chemical Co., Ltd. (JP) 2006-04-26 EP disclosed
US-20040079922-A1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEMICAL CO., LTD. (JP) 2004-04-29 US disclosed
EP-1371712-A1 LIQUID-CRYSTAL COMPOSITION CONTAINING OPTICALLY ACTIVE COMPOUND AND LIQUID-CRYSTAL ELECTROOPTIC ELEMENT Seimi Chemical Co., Ltd. (JP) 2003-12-17 EP disclosed