SCHEMBL7555433

SCHEMBL7555433

[CH2]CCCCCCCC(=O)NC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
HDAC3 O15379 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC5 Q9UQL6 2/20 0.44
HSP90AA1 P07900 1/20 0.41
FAAH O00519 5/20 0.40
NAMPT P43490 1/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 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
SCHEMBL1416050 1.00 LMNA (0.44) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL7552592 1.00 LMNA (0.44) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL28425807 1.00 LMNA (0.44) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL5541584 0.98
SCHEMBL498068 0.90
SCHEMBL5909431 0.87 HDAC3 (0.55) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL5909483 0.87 HDAC3 (0.55) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL12333287 0.87 HDAC3 (0.55) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL6159056 0.87 HDAC3 (0.55) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL29315161 0.87 HDAC3 (0.55) LMNAHDAC3HDAC1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1812981-A Heteroaryloxy nitrogenous saturated heterocyclic derivative BANYU PHARMA CO LTD (JP) 2006-08-02 CN disclosed
EP-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 EP disclosed