SCHEMBL30480147

SCHEMBL30480147

COC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)[C@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.48
GRB2 P62993 1/20 0.41
MDM4 O15151 1/20 0.40
TP53 P04637 1/20 0.40
MDM2 Q00987 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL29978516 0.96 PTPN1 (0.49) PTPN1GRB2MDM4TP53MDM2
SCHEMBL30590007 0.93 PTPN1 (0.45) PTPN1GRB2MDM4TP53BACE1
SCHEMBL30589998 0.92 PTPN1 (0.45) PTPN1GRB2MDM4TP53
SCHEMBL30589994 0.92 PTPN1 (0.45) PTPN1GRB2MDM4TP53
SCHEMBL30590008 0.91 PTPN1 (0.53) PTPN1GRB2MDM2
SCHEMBL29978837 0.89 PTPN1 (0.46) PTPN1GRB2MDM4TP53BACE1
SCHEMBL29978246 0.89 PTPN1 (0.46) PTPN1GRB2MDM4TP53
SCHEMBL29978024 0.87 PTPN1 (0.54) PTPN1GRB2MDM4TP53MDM2
SCHEMBL1770944 0.86 PTPN1 (0.41) PTPN1GRB2MDM4TP53MDM2
SCHEMBL1770431 0.85 PTPN1 (0.41) PTPN1MDM4TP53MDM2BACE1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11970551-B2 Solution phase routes for WNT hexapeptides WNTRESEARCH AB (SE) 2024-04-30 US disclosed
US-11912791-B2 Solution phase routes for Wnt hexapeptides WNTRESEARCH AB (SE) 2024-02-27 US disclosed
US-20230295232-A1 SOLUTION PHASE ROUTES FOR WNT HEXAPEPTIDES WNTRESEARCH AB (SE) 2023-09-21 US disclosed
EP-3841107-B1 SOLUTION PHASE ROUTES FOR WNT HEXAPEPTIDES WNTRESEARCH AB (SE) 2023-06-28 EP disclosed