SCHEMBL8029010

SCHEMBL8029010

COC(=O)CNC(=O)CCCCNC(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 10/20 0.63
HDAC1 Q13547 7/20 0.63
HDAC8 Q9BY41 6/20 0.63
HDAC3 O15379 5/20 0.63
HDAC2 Q92769 5/20 0.63
HDAC4 P56524 4/20 0.63
HDAC7 Q8WUI4 4/20 0.63
HDAC10 Q969S8 4/20 0.63
HDAC11 Q96DB2 4/20 0.63
HDAC9 Q9UKV0 4/20 0.63
HDAC5 Q9UQL6 4/20 0.63
RECQL P46063 1/20 0.58
NAAA Q02083 1/20 0.56
NCOR2 Q9Y618 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PRSS1 P07477 1/20 0.54
CTSG P08311 1/20 0.54
CTRB1 P17538 1/20 0.54
CMA1 P23946 1/20 0.54
MAPK1 P28482 1/20 0.51

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
SCHEMBL8030824 0.99 HDAC6 (0.66) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL8028984 0.89 HDAC6 (0.68) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL8019515 0.89 HDAC6 (0.68) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL8029208 0.88 HDAC1 (0.66) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL8019496 0.88 HDAC6 (0.66) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL8029037 0.87 GAA (0.62) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12672001 0.85 NAAA (0.67) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL8770687 0.84 HDAC6 (0.73) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL8032587 0.82 HDAC1 (0.58) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL27419582 0.82 GPR139 (0.55) SMN1; SMN2PRSS1CTSGCTRB1CMA1

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
EP-0797579-B1 ERYTHROMYCIN A 9-0-OXIME DERIVATIVES ENDOWED WITH ANTIBIOTIC ACTIVITY ZAMBON SPA (IT) 2000-03-15 EP disclosed
CN-1046535-C Erythromycin A 9-0-oxime derivatives endowed with antibiotic activity ZAMBON SPA (IT) 1999-11-17 CN disclosed
US-5847092-A Erythromycin A 9-0 oxime derivatives endowed with antibiotic activity ZAMBON GROUP S.P.A. (IT) 1998-12-08 US disclosed
CN-1169727-A Erythromycin A 9-0-oxime derivatives endowed with antibiotic activity ZAMBON SPA (IT) 1998-01-07 CN disclosed