SCHEMBL27216580

SCHEMBL27216580

COC(=O)/C=C/C(=O)N1CC2(CN(C(=O)O)C2)C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.47
▸ HTT P42858 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ HCAR2 Q8TDS4 2/20 0.45
▸ KEAP1 Q14145 1/20 0.45
▸ NFE2L2 Q16236 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.39
▸ GPX4 P36969 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.33
▸ GPR183 P32249 1/20 0.32
▸ GFPT1 Q06210 1/20 0.32
▸ ALOX15 P16050 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL24881235 0.81 HCAR2 (0.43) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL2189172 0.80 ALDH1A1 (0.62) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL2189175 0.80 ALDH1A1 (0.62) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL28979818 0.79 HCAR2 (0.41) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL27216617 0.78 HCAR2 (0.35) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL24881236 0.75 ALDH1A1 (0.38) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL25698382 0.72 ALDH1A1 (0.57) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL7397962 0.68 ALDH1A1 (0.56) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL2190802 0.68 ALDH1A1 (0.53) ALDH1A1HTTMAPTHCAR2KEAP1
SCHEMBL2190798 0.68 ALDH1A1 (0.53) ALDH1A1HTTMAPTHCAR2KEAP1

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
EP-4368614-A1 SYNTHESIS AND APPLICATION OF PHOSPHATASE DEGRADER Hinova Pharmaceuticals Inc. (CN) 2024-05-15 — — EP disclosed
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