SCHEMBL7995733

SCHEMBL7995733

NC(=O)CCCCCN1Cc2ccccc2C1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 3/20 0.67
HDAC3 O15379 2/20 0.67
HDAC4 P56524 2/20 0.67
HDAC1 Q13547 2/20 0.67
HDAC7 Q8WUI4 2/20 0.67
HDAC2 Q92769 2/20 0.67
HDAC10 Q969S8 2/20 0.67
HDAC11 Q96DB2 2/20 0.67
HDAC8 Q9BY41 2/20 0.67
HDAC9 Q9UKV0 2/20 0.67
HDAC5 Q9UQL6 2/20 0.67
KDM4E B2RXH2 2/20 0.65
ALOX15 P16050 1/20 0.65
TSHR P16473 1/20 0.65
SIRT1 Q96EB6 1/20 0.65
HTR7 P34969 2/20 0.57
ALDH1A1 P00352 1/20 0.57
HPGD P15428 1/20 0.57
DRD2 P14416 3/20 0.55
DRD5 P21918 3/20 0.55

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
SCHEMBL7997184 0.94 KDM4E (0.68) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL3785757 0.90 KDM4E (0.75) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL13593314 0.89 KDM4E (0.78) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL3383921 0.89 KDM4E (0.78) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL7433345 0.82 KDM4E (0.83) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL24437908 0.82 KDM4E (0.63) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL20329971 0.81 HTR7 (0.61) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL13910341 0.81 HTR7 (0.61) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL9375915 0.81 HTR7 (0.61) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL18612248 0.81 HTR7 (0.61) HDAC6HDAC3HDAC4HDAC1HDAC7

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
WO-2010014554-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITION FOR THE TREATMENT OF COLLAPSING GLOMERULOPATHY AND OTHER GLOMERULAR DISEASE GENZYME CORPORATION (US) 2010-02-04 WO disclosed
WO-2009117150-A2 METHOD OF TREATING LUPUS WITH CERAMIDE DERIVATIVES GENZYME CORPORATION (US) 2009-09-24 WO disclosed