SCHEMBL30819573

SCHEMBL30819573

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

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.62
MDM2 Q00987 7/20 0.57
MDM4 O15151 3/20 0.56
TP53 P04637 3/20 0.56
TLR2 O60603 2/20 0.55
CASP3 P42574 2/20 0.53
PTPN1 P18031 1/20 0.49

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
SCHEMBL30749111 1.00 KMT2A (0.62) KMT2AMDM2MDM4TP53TLR2
SCHEMBL19951678 1.00 KMT2A (0.62) KMT2AMDM2MDM4TP53TLR2
SCHEMBL7461050 0.96 KMT2A (0.64) KMT2AMDM2MDM4TP53TLR2
SCHEMBL30749158 0.95 KMT2A (0.66) KMT2AMDM2MDM4TP53TLR2
SCHEMBL12466711 0.95 KMT2A (0.66) KMT2AMDM2MDM4TP53TLR2
SCHEMBL14997839 0.93 KMT2A (0.58) KMT2AMDM2MDM4TP53TLR2
SCHEMBL29354378 0.93 KMT2A (0.58) KMT2AMDM2MDM4TP53TLR2
SCHEMBL29908078 0.93 KMT2A (0.58) KMT2AMDM2MDM4TP53TLR2
SCHEMBL30338216 0.93 KMT2A (0.58) KMT2AMDM2MDM4TP53TLR2
SCHEMBL29400089 0.93 KMT2A (0.58) KMT2AMDM2MDM4TP53TLR2

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
EP-4605409-A2 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2025-08-27 EP disclosed
WO-2024086814-A2 CYCLIN INHIBITORS CIRCLE PHARMA, INC. (US) 2024-04-25 WO disclosed