SCHEMBL10355202

SCHEMBL10355202

CC[C@H](C)CCCCC(=O)c1ccc(-c2ccc(OC)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.55
HDAC8 Q9BY41 4/20 0.53
HDAC1 Q13547 4/20 0.53
MAPT P10636 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CYP3A4 P08684 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 1/20 0.47
MMP1 P03956 1/20 0.47
HDAC3 O15379 2/20 0.45
HDAC4 P56524 2/20 0.45
HDAC7 Q8WUI4 2/20 0.45
HDAC2 Q92769 2/20 0.45
HDAC10 Q969S8 2/20 0.45
HDAC11 Q96DB2 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45

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
SCHEMBL10745086 0.90 MAPT (0.53) PDE4BHDAC8HDAC1MAPTMEN1
SCHEMBL10745082 0.90 MAPT (0.53) PDE4BHDAC8HDAC1MAPTMEN1
SCHEMBL3383975 0.83 PDE4B (0.55) PDE4BHDAC8HDAC1MAPTMEN1
SCHEMBL22034392 0.81 HDAC8 (0.64) PDE4BHDAC8HDAC1MAPTL3MBTL1
SCHEMBL12855893 0.81 PDE4B (0.62) PDE4BHDAC8HDAC1MAPTMEN1
SCHEMBL3171960 0.81 PDE4B (0.79) PDE4BHDAC8HDAC1MAPTKMT2A
SCHEMBL7180991 0.79 HDAC8 (0.54) PDE4BHDAC8HDAC1MAPTMEN1
SCHEMBL10585461 0.79 STS (0.49) KMT2ANPC1RAB9AL3MBTL1
SCHEMBL10585963 0.79 STS (0.49) KMT2ANPC1RAB9AL3MBTL1
SCHEMBL3383272 0.79 PDE4B (0.82) PDE4BHDAC8HDAC1MAPTMEN1

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
EP-0256307-B1 OPTICALLY ACTIVE COMPOUNDS HAVING BIPHENYL SKELETON, LIQUID CRYSTAL COMPOSITION AND SWITCHING ELEMENT CONTAINING THEM Chisso Corporation (JP) 1990-10-03 EP disclosed