SCHEMBL29624364

SCHEMBL29624364

O=C(O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.59
KMT2A Q03164 2/20 0.53
MDM4 O15151 1/20 0.48
TP53 P04637 1/20 0.48
EPHX2 P34913 1/20 0.48
FABP7 O15540 1/20 0.44
FABP5 Q01469 1/20 0.44

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
SCHEMBL3835254 1.00 CASP3 (0.59) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL3199894 1.00 CASP3 (0.59) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL31299005 1.00 CASP3 (0.59) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL3199882 1.00 CASP3 (0.59) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL26654416 0.99 CASP3 (0.58) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL26654411 0.99 CASP3 (0.58) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL5846051 0.93 CASP3 (0.55) CASP3KMT2AMDM4TP53
SCHEMBL3230119 0.92 CASP3 (0.54) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL7198189 0.92 CASP3 (0.54) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL3725037 0.92 CASP3 (0.54) CASP3KMT2AMDM4TP53EPHX2

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-119818387-A Application and synthesis method of cyclic peptide 上海中翊日化有限公司 2025-04-15 CN disclosed