SCHEMBL38664431

SCHEMBL38664431

COC(C(=O)Nc1c(C(=O)O)cc(C)nc1C)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 7/20 0.47
▸ GAA P10253 3/20 0.47
▸ CCNA2 P20248 2/20 0.46
▸ CDK2 P24941 2/20 0.46
▸ CCNA1 P78396 2/20 0.46
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ LMNA P02545 2/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ GLS O94925 2/20 0.43

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
SCHEMBL38663306 0.81 KDM4E (0.48) KDM4EALDH1A1GAACCNA2CDK2
SCHEMBL38666073 0.81 KDM4E (0.48) KDM4EALDH1A1GAACCNA2CDK2
SCHEMBL38664985 0.76 LMNA (0.48) KDM4EALDH1A1GAAL3MBTL1LMNA
SCHEMBL38666687 0.72 KEAP1 (0.47) KDM4EALDH1A1GAACCNA2CDK2
SCHEMBL38666425 0.72 KDM4E (0.53) KDM4EALDH1A1GAACCNA2CDK2
SCHEMBL38666751 0.71 KDM4E (0.45) KDM4EALDH1A1GAAL3MBTL1LMNA
SCHEMBL38666380 0.71 MEN1 (0.45) KDM4EALDH1A1GAAL3MBTL1KMT2A
SCHEMBL38663305 0.71 ALDH1A1 (0.54) KDM4EALDH1A1GAACCNA2CDK2
SCHEMBL38664442 0.71 ALDH1A1 (0.43) KDM4EALDH1A1GAAL3MBTL1LMNA
SCHEMBL38666391 0.71 MEN1 (0.45) KDM4EALDH1A1GAAL3MBTL1KMT2A

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
WO-2026104679-A1 NOVEL SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2026-05-21 — — WO disclosed
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