SCHEMBL29517835

SCHEMBL29517835

Cc1ccc(-c2noc(C(=O)NCCc3ccccn3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
LMNA P02545 1/20 0.60
PKM P14618 1/20 0.60
RAB9A P51151 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 2/20 0.52
MEN1 O00255 1/20 0.48
TSHR P16473 1/20 0.48
NAMPT P43490 1/20 0.47
GSK3B P49841 1/20 0.47

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
SCHEMBL29517879 0.91 KMT2A (0.62) KMT2ALMNAPKMRAB9ASMN1; SMN2
SCHEMBL29517953 0.89 KMT2A (0.60) KMT2ALMNAPKMRAB9ASMN1; SMN2
SCHEMBL29517972 0.85 KMT2A (0.56) KMT2ALMNAPKMRAB9ASMN1; SMN2
SCHEMBL13947349 0.80 RAB9A (0.65) KMT2ALMNARAB9ASMN1; SMN2NPC1
SCHEMBL29517825 0.80 SMN1; SMN2 (0.73) KMT2ALMNAPKMRAB9ASMN1; SMN2
SCHEMBL19380261 0.79 KDM4E (0.54) SMN1; SMN2GSK3B
SCHEMBL30129915 0.77 MAPT (0.61) KMT2ASMN1; SMN2
SCHEMBL24325692 0.77 KDM4E (0.52) GSK3B
SCHEMBL19380242 0.77 GSK3B (0.58) KMT2ALMNASMN1; SMN2NPC1MEN1
SCHEMBL28607764 0.74 HIF1A (0.65) KMT2ARAB9ASMN1; SMN2NPC1GSK3B

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-114213403-B 1,2,4-oxadiazole-5-formamide derivative and preparation method and application thereof 贵州大学 2022-10-25 CN claimed
CN-114213403-A 1,2, 4-oxadiazole-5-formamide derivatives and preparation method and application thereof 贵州大学 2022-03-22 CN claimed
CN-114213403-B 1,2,4-oxadiazole-5-formamide derivative and preparation method and application thereof 贵州大学 2022-10-25 CN disclosed
CN-114213403-A 1,2, 4-oxadiazole-5-formamide derivatives and preparation method and application thereof 贵州大学 2022-03-22 CN disclosed