SCHEMBL30848945

SCHEMBL30848945

C[C@@H](O)[C@H](NC(=O)N[C@@H](CC(N)=O)c1nc(N2CCNCC2)no1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.61
VSIR Q9H7M9 3/20 0.61
PDCD1LG2 Q9BQ51 2/20 0.44
PDCD1 Q15116 1/20 0.41
MMP12 P39900 1/20 0.30

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
SCHEMBL19866987 1.00 CD274 (0.61) CD274VSIRPDCD1LG2PDCD1MMP12
SCHEMBL18077975 1.00 CD274 (0.61) CD274VSIRPDCD1LG2PDCD1MMP12
SCHEMBL18077940 0.91 CD274 (0.64) CD274VSIRPDCD1LG2PDCD1
SCHEMBL19866981 0.91 CD274 (0.64) CD274VSIRPDCD1LG2PDCD1
SCHEMBL18077963 0.91 CD274 (0.64) CD274VSIRPDCD1LG2PDCD1
SCHEMBL19867028 0.91 CD274 (0.64) CD274VSIRPDCD1LG2PDCD1
SCHEMBL19867082 0.90 CD274 (0.63) CD274VSIRPDCD1LG2PDCD1
SCHEMBL19867020 0.90 CD274 (0.63) CD274VSIRPDCD1LG2PDCD1
SCHEMBL18077976 0.90 CD274 (0.63) CD274VSIRPDCD1LG2PDCD1
SCHEMBL18077927 0.90 CD274 (0.63) CD274VSIRPDCD1LG2PDCD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4577306-A1 COMBINATION CANCER TREATMENT COMPRISING AN ANTI-MSLN/CD137 ANTIBODY AND PD-1/PD-L1 INHIBITOR Merck Patent GmbH (DE) 2025-07-02 EP disclosed
CN-119836302-A Combination cancer treatment comprising anti-MSLN/CD 137 antibodies and PD-1/PD-L1 inhibitors 默克专利股份公司 2025-04-15 CN disclosed
WO-2024042104-A1 COMBINATION CANCER TREATMENT COMPRISING AN ANTI-MSLN/CD137 ANTIBODY AND PD-1/PD-L1 INHIBITOR MERCK PATENT GMBH (DE) 2024-02-29 WO disclosed