SCHEMBL2915315

SCHEMBL2915315

COCCS(=O)(=O)Nc1ccc(NC(=O)c2cc(N3C(=O)CCNC3=O)cc(C(C)(C)C)c2O)cc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF18A Q8NI77 11/20 0.35
BCL2L1 Q07817 2/20 0.34
ITGA4 P13612 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NR1H4 Q96RI1 2/20 0.32
BCL2 P10415 1/20 0.32
MCL1 Q07820 1/20 0.32
SIRT5 Q9NXA8 1/20 0.32
POLB P06746 1/20 0.31
F10 P00742 1/20 0.31

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
SCHEMBL2909532 0.91 NR1H4 (0.39) KIF18AITGA4L3MBTL1NR1H4BCL2
SCHEMBL2907832 0.88 BCL2L1 (0.34) KIF18ABCL2L1ITGA4L3MBTL1BCL2
SCHEMBL2913154 0.88 BCL2L1 (0.35) KIF18ABCL2L1ITGA4L3MBTL1NR1H4
SCHEMBL2913166 0.87 XDH (0.38) KIF18ABCL2L1ITGA4L3MBTL1
SCHEMBL2908230 0.86 ITGA4 (0.41) ITGA4L3MBTL1POLB
SCHEMBL2913374 0.85 BCL2L1 (0.36) KIF18ABCL2L1ITGA4L3MBTL1NR1H4
SCHEMBL2913787 0.85 KIF18A (0.39) KIF18ANR1H4BCL2
SCHEMBL2910190 0.83 GPR27 (0.42)
SCHEMBL2910683 0.83 ALDH1A1 (0.36) BCL2L1ITGA4L3MBTL1NR1H4F10
SCHEMBL2908073 0.83 NR1H4 (0.47) ITGA4L3MBTL1NR1H4

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-2222646-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C Abbott Laboratories (US) 2010-09-01 EP disclosed
WO-2009039127-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed