SCHEMBL29129108

SCHEMBL29129108

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

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.54
▸ TP53 P04637 3/20 0.54
▸ CASP3 P42574 2/20 0.48
▸ TLR2 O60603 2/20 0.48
▸ MDM2 Q00987 7/20 0.48
▸ TNF P01375 1/20 0.47

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
SCHEMBL29129111 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL29613460 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL29613539 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL20546469 0.90 MDM4 (0.53) MDM4TP53CASP3TLR2MDM2
SCHEMBL17981392 0.90 MDM4 (0.53) MDM4TP53CASP3TLR2MDM2
SCHEMBL19899314 0.88 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL31000735 0.88 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL30191422 0.88 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL31165326 0.88 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL29401864 0.88 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2

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-117279636-A Methods and compounds for modulating myotonic muscular dystrophy type 1 设计治疗公司 2023-12-22 — — CN disclosed
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