SCHEMBL7553441

SCHEMBL7553441

[CH2]CCCCCCC(=O)NC1CCCCC1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.75
HDAC3 O15379 2/20 0.69
HDAC1 Q13547 2/20 0.69
HDAC2 Q92769 2/20 0.69
HDAC10 Q969S8 2/20 0.69
HDAC11 Q96DB2 2/20 0.69
HDAC8 Q9BY41 2/20 0.69
HDAC6 Q9UBN7 2/20 0.69
NCOR2 Q9Y618 1/20 0.69
ALDH1A1 P00352 3/20 0.58
HPGD P15428 4/20 0.56
EPHX1 P07099 3/20 0.55
GAA P10253 1/20 0.54
EPHX2 P34913 1/20 0.53
KMT2A Q03164 2/20 0.50
MAPK1 P28482 1/20 0.49
MEN1 O00255 1/20 0.48
GNAI3 P08754 1/20 0.47
GNAO1 P09471 1/20 0.47
GNAI1 P63096 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
SCHEMBL9701471 0.98 SMN1; SMN2 (0.78) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL8429090 0.93 SMN1; SMN2 (0.74) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL7551049 0.91 SMN1; SMN2 (0.64) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL17204390 0.91 SMN1; SMN2 (0.77) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL38658755 0.91 SMN1; SMN2 (0.91) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL9337868 0.89 SMN1; SMN2 (0.95) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL28668503 0.89 SMN1; SMN2 (0.95) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL15480466 0.85 SMN1; SMN2 (0.81) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL7228325 0.85 SMN1; SMN2 (0.67) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL4404544 0.84 SMN1; SMN2 (0.78) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10

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-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 EP disclosed