SCHEMBL31095177

SCHEMBL31095177

Fc1ccc(Br)c(/C=C\c2cccnc2F)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 6/20 0.42
▸ NAPRT Q6XQN6 1/20 0.39
▸ CYP11B2 P19099 2/20 0.36
▸ TRIM24 O15164 1/20 0.36
▸ TRIM33 Q9UPN9 1/20 0.36
▸ RELA Q04206 1/20 0.35
▸ SNCA P37840 1/20 0.35
▸ AMY1A P0DUB6 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ TDO2 P48775 1/20 0.33

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
SCHEMBL31095221 0.87 NFE2L2 (0.42) NFE2L2NAPRTCYP11B2TRIM24TRIM33
SCHEMBL31095224 0.83 HSD11B1 (0.43) NFE2L2NAPRTTRIM24TRIM33RELA
SCHEMBL31095207 0.83 HSD11B1 (0.43) NFE2L2NAPRTTRIM24TRIM33RELA
SCHEMBL31095227 0.81 CSNK1A1 (0.38) NAPRTCYP11B2TRIM24TRIM33PDE10A
SCHEMBL8486928 0.80 NAPRT (0.48) NFE2L2NAPRTTRIM24TRIM33AMY1A
SCHEMBL8486922 0.80 NAPRT (0.48) NFE2L2NAPRTTRIM24TRIM33AMY1A
SCHEMBL31095230 0.73 NFE2L2 (0.47) NFE2L2NAPRTTRIM24TRIM33
SCHEMBL31095185 0.70 NFE2L2 (0.53) NFE2L2NAPRTTRIM24TRIM33
SCHEMBL22001870 0.70 F2RL1 (0.40) NFE2L2RELAAMY1A
SCHEMBL27707635 0.70 F2RL1 (0.40) NFE2L2RELAAMY1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4680602-A1 HETEROCYCLIC COMPOUNDS AS SELECTIVE HDAC6 INHIBITORS Miralinc Pharma, Inc. (US) 2026-01-21 — — EP disclosed
WO-2024192237-A1 HETEROCYCLIC COMPOUNDS AS SELECTIVE HDAC6 INHIBITORS MIRALINC PHARMA, INC. (US) 2024-09-19 — — WO disclosed
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