SCHEMBL4207148

SCHEMBL4207148

CCCCCCCCCCCC(=O)OCc1ccc(C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.49
HDAC1 Q13547 2/20 0.49
HDAC2 Q92769 2/20 0.49
DGKA P23743 1/20 0.49
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PAM P19021 2/20 0.45
HPGD P15428 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
ELANE P08246 5/20 0.44
NR4A2 P43354 1/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43

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
SCHEMBL4213343 1.00 HDAC3 (0.49) HDAC3HDAC1HDAC2DGKAALDH1A1
SCHEMBL4216103 1.00 HDAC3 (0.49) HDAC3HDAC1HDAC2DGKAALDH1A1
SCHEMBL4212739 1.00 HDAC3 (0.49) HDAC3HDAC1HDAC2DGKAALDH1A1
SCHEMBL4210162 1.00 HDAC3 (0.49) HDAC3HDAC1HDAC2DGKAALDH1A1
SCHEMBL4220388 1.00 HDAC3 (0.49) HDAC3HDAC1HDAC2DGKAALDH1A1
SCHEMBL3814877 0.89 DGKA (0.60) DGKAALDH1A1MAPTMEN1KMT2A
SCHEMBL22334759 0.86 DGKA (0.42) DGKAALDH1A1MAPTMEN1KMT2A
SCHEMBL4207553 0.84 DGKA (0.55) DGKAALDH1A1MAPTMEN1KMT2A
SCHEMBL18087035 0.84 DGKA (0.55) DGKAALDH1A1MAPTMEN1KMT2A
SCHEMBL4206910 0.84 DGKA (0.55) DGKAALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7494537-B2 Thermochromic coloring color-memory composition and thermochromic coloring color-memory microcapsule pigment containing the same THE PILOT INK CO., LTD. (JP) 2009-02-24 US disclosed
EP-1657073-B1 Reversible thermochromic composition and microcapsules containing the same PILOT INK CO LTD (JP) 2008-02-27 EP disclosed
US-20060112851-A1 Thermochromic coloring color-memory composition and thermochromic coloring color-memory microcapsule pigment containing the same THE PILOT INK CO., LTD. 2006-06-01 US disclosed
EP-1657073-A2 Reversible thermochromic composition and microcapsules containing the same THE PILOT INK CO., LTD. (JP) 2006-05-17 EP disclosed