SCHEMBL30424923

SCHEMBL30424923

CN1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccc(-c5nnc(C(F)F)o5)cn4)nn3)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 10/20 0.49
▸ HDAC1 Q13547 5/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ KDR P35968 2/20 0.43
▸ TEK Q02763 1/20 0.43
▸ NAMPT P43490 3/20 0.40

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
SCHEMBL25267691 1.00 HDAC6 (0.49) HDAC6HDAC1KDM4EKDRTEK
SCHEMBL25386481 0.92 HDAC6 (0.46) HDAC6HDAC1KDRTEKNAMPT
SCHEMBL30425562 0.92 HDAC6 (0.46) HDAC6HDAC1KDRTEKNAMPT
SCHEMBL30425218 0.90 HDAC6 (0.51) HDAC6HDAC1KDM4EKDRTEK
SCHEMBL25254557 0.90 HDAC6 (0.51) HDAC6HDAC1KDM4EKDRTEK
SCHEMBL25350857 0.89 HDAC6 (0.53) HDAC6HDAC1
SCHEMBL30424695 0.88 HDAC6 (0.51) HDAC6HDAC1KDRTEK
SCHEMBL25216547 0.88 HDAC6 (0.51) HDAC6HDAC1KDRTEK
SCHEMBL25254596 0.88 KDM4E (0.45) HDAC6HDAC1KDM4EKDRTEK
SCHEMBL30424957 0.88 KDM4E (0.45) HDAC6HDAC1KDM4EKDRTEK

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
CN-116157398-B Oxadiazole-based selective histone deacetylase 6 inhibitors 意大发马克股份公司 2025-03-11 — — CN claimed
CN-116157398-A 2- (4- ((5- (benzo [ b ] thiophen-3-yl) -1H-tetrazol-1-yl) methyl) phenyl) -5- (difluoromethyl) -1,3, 4-oxadiazole derivatives and similar compounds as selective inhibitors of histone deacetylase 6 (HDAC 6) for the treatment of, for example, peripheral neuropathy 意大发马克股份公司 2023-05-23 — — CN claimed
CN-116157398-B Oxadiazole-based selective histone deacetylase 6 inhibitors 意大发马克股份公司 2025-03-11 — — CN disclosed
CN-116157398-A 2- (4- ((5- (benzo [ b ] thiophen-3-yl) -1H-tetrazol-1-yl) methyl) phenyl) -5- (difluoromethyl) -1,3, 4-oxadiazole derivatives and similar compounds as selective inhibitors of histone deacetylase 6 (HDAC 6) for the treatment of, for example, peripheral neuropathy 意大发马克股份公司 2023-05-23 — — CN disclosed
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