SCHEMBL30460239

SCHEMBL30460239

CC(C)(C)OC(=O)N1CCN(c2cccc(-c3cn(Cc4ccc(-c5nnc(C(F)F)o5)cn4)nn3)c2F)CC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 10/20 0.44
▸ KDM1A O60341 5/20 0.40
▸ HDAC1 Q13547 2/20 0.38
▸ KDM1B Q8NB78 1/20 0.38
▸ RET P07949 3/20 0.37
▸ GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL25350597 1.00 HDAC6 (0.44) HDAC6KDM1AHDAC1KDM1BRET
SCHEMBL25349877 0.90 HDAC6 (0.44) HDAC6KDM1AKDM1B
SCHEMBL30460314 0.90 HDAC6 (0.44) HDAC6KDM1AKDM1B
SCHEMBL30460211 0.88 HDAC6 (0.47) HDAC6KDM1AHDAC1RET
SCHEMBL25351650 0.88 HDAC6 (0.47) HDAC6KDM1AHDAC1RET
SCHEMBL25349968 0.88 HDAC1 (0.43) HDAC6KDM1AHDAC1KDM1B
SCHEMBL30460250 0.88 HDAC1 (0.43) HDAC6KDM1AHDAC1KDM1B
SCHEMBL30460187 0.87 HDAC6 (0.48) HDAC6HDAC1
SCHEMBL25350692 0.87 HDAC6 (0.48) HDAC6HDAC1
SCHEMBL25349552 0.85 HDAC6 (0.46) HDAC6HDAC1

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-4185586-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2023-05-31 — — EP disclosed
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