SCHEMBL30424168

SCHEMBL30424168

NC(=O)c1cccc(-c2nnn(Cc3ccc(-c4nnc(C(F)F)o4)cn3)n2)c1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 14/20 0.74
▸ HDAC1 Q13547 6/20 0.46
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL25219971 1.00 HDAC6 (0.74) HDAC6HDAC1NPC1RAB9ASMN1; SMN2
SCHEMBL25214603 0.87 HDAC6 (0.62) HDAC6NPC1RAB9ASMN1; SMN2
SCHEMBL30425006 0.87 HDAC6 (0.62) HDAC6NPC1RAB9ASMN1; SMN2
SCHEMBL25217339 0.87 HDAC6 (0.68) HDAC6HDAC1
SCHEMBL25350015 0.85 HDAC6 (1.00) HDAC6HDAC1RAB9A
SCHEMBL30409129 0.85 HDAC6 (1.00) HDAC6HDAC1RAB9A
SCHEMBL25215214 0.84 HDAC6 (0.72) HDAC6HDAC1
SCHEMBL25217344 0.84 HDAC6 (0.52) HDAC6HDAC1
SCHEMBL25258527 0.84 HDAC6 (0.52) HDAC6HDAC1
SCHEMBL30425038 0.84 HDAC6 (0.52) 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 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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