SCHEMBL30632963

SCHEMBL30632963

Fc1ccccc1C=Cc1ncco1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 13/20 0.55
▸ GRM4 Q14833 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.43
▸ RELA Q04206 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ METAP2 P50579 1/20 0.40
▸ HTR2A P28223 1/20 0.38

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
SCHEMBL30632983 0.81 NAPRT (0.36) NFE2L2GRM4KDM4ENPC1PKM
SCHEMBL30632951 0.81 NFE2L2 (0.44) NFE2L2KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL30632906 0.80 NUDT1 (0.36) NFE2L2GRM4
SCHEMBL30632897 0.80 NFE2L2 (0.50) NFE2L2HTR2A
SCHEMBL30632929 0.79 MAPT (0.53) NFE2L2KDM4ERELANPC1PKM
SCHEMBL30632909 0.79 NFKB1 (0.45) NFE2L2NFKB1RAB9A
SCHEMBL30632910 0.78 NFE2L2 (0.44) NFE2L2KDM4E
SCHEMBL30633073 0.78 NPC1 (0.36) NFE2L2KDM4ENPC1PKMRAB9A
SCHEMBL30632943 0.78 NFE2L2 (0.33) NFE2L2GRM4NPC1RAB9ASMN1; SMN2
SCHEMBL15870902 0.77 — —

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
CN-111886234-B Heterocyclic mitochondrial activity inhibitors and uses thereof 蒙特利尔大学 2023-12-15 — — CN disclosed
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