SCHEMBL14864149

SCHEMBL14864149

CCCCCCCCCCCCCC(=O)Nc1c(C)cc(Cc2cc(C)c(NC(=O)CCCCCCCCCCCCC)c(C)c2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.56
POLB P06746 1/20 0.56
ALDH1A1 P00352 3/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
GAA P10253 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL13129137 0.98 HPGD (0.58) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL13129134 0.93 HPGD (0.63) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL14864152 0.91 HPGD (0.51) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL13129141 0.90 HPGD (0.53) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL14049582 0.87 HPGD (0.72) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL14864150 0.86 HPGD (0.49) HPGDPOLBGAATDP1L3MBTL1
SCHEMBL30794436 0.86 ALDH1A1 (0.68) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL30794409 0.86 ALDH1A1 (0.68) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL13129138 0.84 HPGD (0.57) HPGDPOLBALDH1A1HDAC3HDAC4
SCHEMBL13129147 0.84 HPGD (0.48) HPGDPOLBGAATDP1L3MBTL1

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-8420721-B2 Polyolefin resin composition ADEKA CORPORATION (JP) 2013-04-16 US disclosed