SCHEMBL32689777

SCHEMBL32689777

C[C@@H](O)[C@H](N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 8/20 0.57
▸ CTSB P07858 3/20 0.53
▸ GRB2 P62993 1/20 0.50
▸ SLC6A2 P23975 1/20 0.44
▸ XIAP P98170 1/20 0.43
▸ DPP3 Q9NY33 1/20 0.42
▸ OPRM1 P35372 2/20 0.42
▸ OPRD1 P41143 1/20 0.42
▸ ANPEP P15144 1/20 0.41
▸ LNPEP Q9UIQ6 1/20 0.41
▸ BDKRB2 P30411 1/20 0.40

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
SCHEMBL29630498 0.96 CAPN1 (0.51) CAPN1CTSBGRB2SLC6A2XIAP
SCHEMBL32689781 0.94 CAPN1 (0.57) CAPN1CTSBGRB2XIAP
SCHEMBL29679608 0.90 CAPN1 (0.49) CAPN1CTSBGRB2SLC6A2XIAP
SCHEMBL29630673 0.90 CAPN1 (0.47) CAPN1CTSBGRB2SLC6A2XIAP
SCHEMBL30817467 0.89 CAPN1 (0.61) CAPN1CTSBGRB2SLC6A2XIAP
SCHEMBL29630574 0.89 CAPN1 (0.49) CAPN1CTSBGRB2SLC6A2XIAP
SCHEMBL29630674 0.88 CAPN1 (0.53) CAPN1CTSBGRB2SLC6A2XIAP
SCHEMBL32689778 0.87 CAPN1 (0.51) CAPN1CTSBGRB2SLC6A2OPRM1
SCHEMBL32689776 0.87 CAPN1 (0.51) CAPN1CTSBGRB2SLC6A2OPRM1
SCHEMBL29396765 0.86 CAPN1 (0.52) CAPN1CTSBGRB2SLC6A2XIAP

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
EP-4039710-B1 ANTI-CD3 ANTIBODIES, ANTI-CD123 ANTIBODIES AND BISPECIFIC ANTIBODIES SPECIFICALLY BINDING TO CD3 AND/OR CD123 SANOFI SA (FR) 2026-03-25 — — EP disclosed
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