SCHEMBL30823637

SCHEMBL30823637

C[C@H](CCS(C)(=O)=O)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.32
APLNR P35414 2/20 0.31

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
SCHEMBL29260407 0.79 KDM4E (0.38) CA2APLNR
SCHEMBL29260409 0.79 KDM4E (0.38) CA2APLNR
SCHEMBL13619245 0.76 CA2 (0.31) CA2
SCHEMBL6497113 0.74 ALDH1A1 (0.37) APLNR
SCHEMBL30190121 0.74 APLNR (0.31) APLNR
SCHEMBL6484661 0.74 ALDH1A1 (0.37) APLNR
SCHEMBL6498785 0.74 ALDH1A1 (0.37) APLNR
SCHEMBL6481437 0.74 ALDH1A1 (0.37) APLNR
SCHEMBL6481430 0.74 ALDH1A1 (0.37) APLNR
SCHEMBL2054509 0.74 CA2 (0.33) CA2

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-117940438-A Heterocyclic compounds as MAP4K1 inhibitors 缆图药品公司 2024-04-26 CN disclosed