SCHEMBL30833163

SCHEMBL30833163

CC(C)(C)[S@@+]([O-])N[C@@H]1C[C@H](O[Si](C)(C)C(C)(C)C)CC12CCN(C(=O)O)CC2

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PPM1D O15297 1/20 0.32

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
SCHEMBL21856128 1.00 PPM1D (0.32) PPM1D
SCHEMBL21952182 1.00 PPM1D (0.32) PPM1D
SCHEMBL22799205 1.00 PPM1D (0.32) PPM1D
SCHEMBL21631570 1.00 PPM1D (0.32) PPM1D
SCHEMBL19641298 0.89 NAMPT (0.37) —
SCHEMBL18392338 0.89 NAMPT (0.37) —
SCHEMBL16925331 0.89 NAMPT (0.37) —
SCHEMBL22084447 0.89 NAMPT (0.37) —
SCHEMBL21918484 0.89 NAMPT (0.37) —
SCHEMBL29467488 0.89 NAMPT (0.37) —

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-115448923-B Pyrimidine-fused ring compound, preparation method and application thereof 上海青煜医药科技有限公司 2024-03-22 — — CN disclosed
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