SCHEMBL29160941

SCHEMBL29160941

CS(=O)(=O)C(=O)Cn1cc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.48
▸ TP53 P04637 3/20 0.48
▸ CASP3 P42574 3/20 0.48
▸ MDM2 Q00987 5/20 0.44
▸ ADAM17 P78536 2/20 0.43
▸ SLC17A5 Q9NRA2 1/20 0.42

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
SCHEMBL29160943 1.00 MDM4 (0.48) MDM4TP53CASP3MDM2ADAM17
SCHEMBL19410235 0.91 MDM4 (0.46) MDM4TP53CASP3MDM2ADAM17
SCHEMBL26008959 0.90 MDM4 (0.50) MDM4TP53CASP3MDM2SLC17A5
SCHEMBL24800805 0.89 MDM4 (0.50) MDM4TP53CASP3MDM2SLC17A5
SCHEMBL9113360 0.88 MDM4 (0.52) MDM4TP53CASP3MDM2SLC17A5
SCHEMBL28383400 0.87 MDM4 (0.47) MDM4TP53CASP3MDM2ADAM17
SCHEMBL30959635 0.86 MDM4 (0.48) MDM4TP53CASP3MDM2SLC17A5
SCHEMBL32664869 0.86 MDM4 (0.48) MDM4TP53CASP3MDM2SLC17A5
SCHEMBL16100700 0.86 MDM4 (0.48) MDM4TP53CASP3MDM2SLC17A5
SCHEMBL30002165 0.86 MDM4 (0.48) MDM4TP53CASP3MDM2SLC17A5

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-110997698-B Immunomodulatory agents acting as PD-1 antagonists 百时美施贵宝公司 2023-12-26 — — CN disclosed
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