SCHEMBL31488855

SCHEMBL31488855

O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)NCC(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.50
▸ MDM4 O15151 3/20 0.48
▸ TP53 P04637 3/20 0.48
▸ CASP3 P42574 2/20 0.48
▸ MDM2 Q00987 1/20 0.47
▸ EPHX2 P34913 1/20 0.46
▸ TLR2 O60603 2/20 0.45
▸ SLC17A5 Q9NRA2 1/20 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
SCHEMBL31488784 1.00 KMT2A (0.50) KMT2AMDM4TP53CASP3MDM2
SCHEMBL31462350 1.00 KMT2A (0.50) KMT2AMDM4TP53CASP3MDM2
SCHEMBL29517012 0.98 KMT2A (0.52) KMT2AMDM4TP53CASP3MDM2
SCHEMBL2367647 0.98 KMT2A (0.52) KMT2AMDM4TP53CASP3MDM2
SCHEMBL30306992 0.90 KMT2A (0.49) KMT2AMDM4TP53CASP3MDM2
SCHEMBL17178126 0.89 KMT2A (0.48) KMT2AMDM4TP53CASP3MDM2
SCHEMBL30288545 0.89 KMT2A (0.48) KMT2AMDM4TP53CASP3MDM2
SCHEMBL17003669 0.89 KMT2A (0.48) KMT2AMDM4TP53CASP3MDM2
SCHEMBL30781784 0.89 KMT2A (0.48) KMT2AMDM4TP53CASP3MDM2
SCHEMBL29561351 0.89 CASP3 (0.55) KMT2AMDM4TP53CASP3MDM2

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
CN-119462826-B Pseudo peptide compound and preparation method and application thereof 成都普康唯新生物科技有限公司 2025-04-25 — — CN disclosed
CN-119462826-A Pseudo peptide compound and preparation method and application thereof 成都普康唯新生物科技有限公司 2025-02-18 — — CN disclosed
Send feedback