SCHEMBL29268424

SCHEMBL29268424

Cc1ccc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.62
▸ PKM P14618 1/20 0.62
▸ TP53 P04637 7/20 0.56
▸ LMNA P02545 3/20 0.56
▸ KMT2A Q03164 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ GNRHR P30968 1/20 0.49
▸ IL1B P01584 2/20 0.49
▸ P2RX7 Q99572 2/20 0.49
▸ MAPT P10636 1/20 0.48
▸ EPHX2 P34913 1/20 0.48
▸ UTS2R Q9UKP6 1/20 0.48

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
SCHEMBL29268419 0.84 NPC1 (0.61) TP53LMNAKMT2AMEN1MAPT
SCHEMBL13947430 0.82 KDM4E (0.80) KDM4EPKMTP53LMNAKMT2A
SCHEMBL30100433 0.81 KDM4E (0.62) KDM4EPKMTP53LMNAKMT2A
SCHEMBL23675376 0.81 KDM4E (0.62) KDM4EPKMTP53LMNAKMT2A
SCHEMBL20615733 0.79 KDM4E (0.79) KDM4EPKMTP53LMNAKMT2A
SCHEMBL3341330 0.79 KDM4E (0.53) KDM4EPKMTP53LMNAKMT2A
SCHEMBL24766315 0.78 KDM4E (0.61) KDM4EPKMTP53LMNAKMT2A
SCHEMBL2601854 0.78 HTR4 (0.66) —
SCHEMBL24896483 0.78 KDM4E (0.48) KDM4EPKMTP53LMNAKMT2A
SCHEMBL1313080 0.78 KDM4E (0.66) KDM4EPKMTP53LMNAMAPT

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-118324682-A 2-Oxo-acetamide compound, pharmaceutical composition containing same and application thereof 中国药科大学 2024-07-12 — — CN disclosed
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