SCHEMBL8107847

SCHEMBL8107847

CCOC(=O)CC[C@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 8/20 0.35
ABCB1 P08183 1/20 0.33
GLA P06280 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
RECQL P46063 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ATM Q13315 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NR1H2 P55055 1/20 0.31
PIK3CD O00329 1/20 0.31
PARP1 P09874 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
SCHEMBL2080032 1.00 SRC (0.35) SRCABCB1GLAALDH1A1KDM4E
SCHEMBL8112273 0.94 SRC (0.34) SRCABCB1GLAALDH1A1KDM4E
SCHEMBL9595062 0.89 NR1H2 (0.32) ABCB1ATMNR1H2PIK3CD
SCHEMBL30752597 0.89 ABCB1 (0.34) ABCB1ATMNR1H2
SCHEMBL2081517 0.88 PPM1D (0.32) ALDH1A1
SCHEMBL4420095 0.86 ABCB1 (0.35) SRCABCB1ALDH1A1NR1H2
SCHEMBL9596446 0.86 ABCB1 (0.35) SRCABCB1ALDH1A1NR1H2
SCHEMBL4421658 0.86 ABCB1 (0.35) SRCABCB1ALDH1A1NR1H2
SCHEMBL24739168 0.85 SRC (0.36) SRCABCB1GLAALDH1A1KDM4E
SCHEMBL9519428 0.85 SRC (0.34) SRCABCB1GLAMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0545290-B1 Aminoalkylpyrrolidinylthiocarbapenem derivatives BANYU PHARMA CO LTD (JP) 2000-08-23 EP disclosed
US-5550121-A ANTIBIOTICS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-08-27 US disclosed
WO-1993011128-A1 AMINOALKYLPYRROLIDINYLTHIOCARBAPENEM DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-06-10 WO disclosed
EP-0545290-A1 Aminoalkylpyrrolidinylthiocarbapenem derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-06-09 EP disclosed