SCHEMBL24968639

SCHEMBL24968639

Cc1cnc(NC2(c3cc(F)cc(F)c3)CCC2)nc1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 20/20 0.59
HDAC3 O15379 17/20 0.59
HDAC1 Q13547 17/20 0.59
HDAC2 Q92769 17/20 0.59

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
SCHEMBL28865439 0.83 HDAC6 (0.56) HDAC6HDAC3HDAC1HDAC2
SCHEMBL19710705 0.82 HDAC6 (0.67) HDAC6HDAC3HDAC1HDAC2
SCHEMBL18742560 0.79 HDAC3 (0.61) HDAC6HDAC3HDAC1HDAC2
SCHEMBL24968632 0.78 HDAC6 (0.62) HDAC6HDAC3HDAC1HDAC2
SCHEMBL18742515 0.77 HDAC3 (0.74) HDAC6HDAC3HDAC1HDAC2
SCHEMBL25575773 0.76 HDAC3 (0.80) HDAC6HDAC3HDAC1HDAC2
SCHEMBL24967738 0.76 HDAC6 (0.52) HDAC6HDAC3HDAC1HDAC2
SCHEMBL28248178 0.76 HDAC6 (0.58) HDAC6HDAC3HDAC1HDAC2
SCHEMBL17025843 0.75 HDAC3 (0.67) HDAC6HDAC3HDAC1HDAC2
SCHEMBL24967732 0.75 HDAC6 (0.64) HDAC6HDAC3HDAC1HDAC2

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-3362445-B1 OXADIAZOLE AMINE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2023-01-25 EP disclosed