SCHEMBL9173643

SCHEMBL9173643

C=C[C@H](C)N(O)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.33
NPSR1 Q6W5P4 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL9177642 1.00 HDAC6 (0.33) HDAC6NPSR1HDAC1HDAC2POLB
SCHEMBL25165406 0.82 HDAC6 (0.33) HDAC6NPSR1HDAC1HDAC2
SCHEMBL23977802 0.81 NPSR1 (0.33) HDAC6NPSR1HDAC1HDAC2
SCHEMBL24490826 0.81 NPSR1 (0.33) HDAC6NPSR1HDAC1HDAC2
SCHEMBL30073859 0.81 NPSR1 (0.33) HDAC6NPSR1HDAC1HDAC2
SCHEMBL2837457 0.80 HDAC6 (0.35) HDAC6HDAC1HDAC2
SCHEMBL23193949 0.79 NPSR1 (0.33) HDAC6NPSR1HDAC1HDAC2
SCHEMBL1028060 0.77 POLB (0.45) HDAC6HDAC1HDAC2POLB
SCHEMBL9063966 0.75 HDAC6 (0.42) HDAC6HDAC1HDAC2
SCHEMBL25165313 0.75 HDAC6 (0.33) HDAC6NPSR1HDAC1HDAC2

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
EP-0652864-A1 HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1995-05-17 EP disclosed
WO-1994002448-A1 HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-03 WO disclosed