SCHEMBL9754778

SCHEMBL9754778

CCCCOC(=O)N1CC(O[Si](C)(C)C(C)(C)C)CC1C1CC(C(N)=O)N(C(=O)OC(C)(C)C)C1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
GBA2 Q9HCG7 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
SCHEMBL9754728 0.92 MEN1 (0.31) MEN1ALDH1A1KMT2AL3MBTL1GBA2
SCHEMBL9020504 0.89 NR1H2 (0.32)
SCHEMBL9754742 0.85 MEN1 (0.32) MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL9596084 0.82 MEN1 (0.30) MEN1ALDH1A1KMT2AL3MBTL1GBA2
SCHEMBL30176172 0.81 UCHL1 (0.36) ALDH1A1
SCHEMBL9020470 0.80 UCHL1 (0.34)
SCHEMBL9596202 0.78 GBA2 (0.32) GBA2
SCHEMBL22980252 0.78 GBA2 (0.36) L3MBTL1GBA2
SCHEMBL9399924 0.76 NR1H2 (0.35) MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL9754776 0.76

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
WO-1991014687-A1 2-(SUBSTITUTED PYRROLIDINYLTHIO)CARBAPENEM DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-10-03 WO disclosed