SCHEMBL7859533

SCHEMBL7859533

CC(C)(C)OC(=O)N1C[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1Cc1ccc(-c2ccc(CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.40
MCL1 Q07820 4/20 0.36
PRMT5 O14744 5/20 0.36
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
PARP1 P09874 1/20 0.36
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
DPP4 P27487 1/20 0.36
ABHD6 Q9BV23 1/20 0.35
DAGLA Q9Y4D2 1/20 0.35
BCL2 P10415 1/20 0.35
BCL2L1 Q07817 1/20 0.35
SRC P12931 4/20 0.34

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
SCHEMBL7859886 0.86 NR1H2 (0.46) ABCB1NR1H2NR1H3PARP1DPP4
SCHEMBL7859737 0.83 MCL1 (0.35) ABCB1MCL1PRMT5BACE1BACE2
SCHEMBL7859855 0.81 ABCB1 (0.38) ABCB1NR1H2NR1H3DPP4SRC
SCHEMBL7862618 0.80 GPR119 (0.42) ABCB1NR1H2NR1H3PARP1
SCHEMBL7853709 0.80 ABCB1 (0.40) ABCB1NR1H2NR1H3PARP1DPP4
SCHEMBL4292542 0.79 ABCB1 (0.47) ABCB1MCL1PRMT5NR1H2NR1H3
SCHEMBL30207112 0.79 ABCB1 (0.47) ABCB1MCL1PRMT5NR1H2NR1H3
SCHEMBL19708616 0.78 ABCB1 (0.56) ABCB1MCL1NR1H2NR1H3PARP1
SCHEMBL7860716 0.77 ABCB1 (0.40) ABCB1PRMT5NR1H2NR1H3PARP1
SCHEMBL1464254 0.76 SRC (0.47) ABCB1PARP1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0747381-B1 CARBAPENEM DERIVATIVE BANYU PHARMA CO LTD (JP) 2001-10-31 EP disclosed
EP-0747381-A1 CARBAPENEM DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-12-11 EP disclosed