SCHEMBL9596084

SCHEMBL9596084

CCCCOC(=O)N1CC(O[Si](C)(C)C(C)(C)C)CC1C1CC(=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
SCHEMBL8106582 0.88 CHRM2 (0.33)
SCHEMBL9754712 0.88 CHRM2 (0.33)
SCHEMBL9754728 0.83 MEN1 (0.31) MEN1ALDH1A1KMT2AL3MBTL1GBA2
SCHEMBL9754778 0.82 MEN1 (0.30) MEN1ALDH1A1KMT2AL3MBTL1GBA2
SCHEMBL8112414 0.82 CHRM2 (0.34) MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL9754742 0.81 MEN1 (0.32) MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL9399979 0.80 AR (0.33) ALDH1A1
SCHEMBL9020561 0.79 ALDH1A1 (0.42) ALDH1A1KMT2A
SCHEMBL17848943 0.79 SMN1; SMN2 (0.36) ALDH1A1L3MBTL1GBA2
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-1993011128-A1 AMINOALKYLPYRROLIDINYLTHIOCARBAPENEM DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-06-10 WO disclosed