SCHEMBL9595771

SCHEMBL9595771

CC(C)(C)OC(=O)N1CC(O[Si](C)(C)C(C)(C)C)CC1C(O)CO

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.36
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
ALDH1A1 P00352 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
IDO1 P14902 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
SCHEMBL8107979 1.00 NR1H2 (0.36) NR1H2MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL8106571 0.92 NR1H2 (0.35) NR1H2MEN1KMT2A
SCHEMBL8112404 0.92 NR1H2 (0.35) NR1H2MEN1KMT2A
SCHEMBL9595653 0.92 NR1H2 (0.35) NR1H2MEN1KMT2A
Water SCHEMBL8098440 0.91 NR1H2 (0.34) NR1H2MEN1KMT2A
SCHEMBL8108016 0.88 NR1H2 (0.32) NR1H2MEN1KMT2A
SCHEMBL8098400 0.87 NR1H2 (0.32) NR1H2
SCHEMBL9595228 0.87 NR1H2 (0.32) NR1H2
SCHEMBL8106756 0.86 NR1H2 (0.31) NR1H2
SCHEMBL8106777 0.86 NR1H2 (0.31) NR1H2

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-1993011128-A1 AMINOALKYLPYRROLIDINYLTHIOCARBAPENEM DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-06-10 WO disclosed