SCHEMBL18922015

SCHEMBL18922015

C[C@H](C(=O)N(C)[C@H](C(=O)OCc1ccccc1)C(C)(C)CO)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.38
SYK P43405 1/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 1/20 0.38
GAA P10253 1/20 0.37
NTSR1 P30989 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL18921954 0.86 POLB (0.42) POLBL3MBTL1SYKNTSR1
SCHEMBL18922014 0.85 POLB (0.41) POLBL3MBTL1SYKNTSR1NPSR1
SCHEMBL30307663 0.85 POLB (0.47) POLBL3MBTL1SYKMAPTNPSR1
SCHEMBL30878162 0.85 POLB (0.47) POLBL3MBTL1SYKMAPTNPSR1
SCHEMBL2499502 0.85 POLB (0.47) POLBL3MBTL1SYKMAPTNPSR1
SCHEMBL23110306 0.83 POLB (0.40) POLBL3MBTL1SYKHTR2CSLC6A4
SCHEMBL23110219 0.80 POLB (0.40) POLBL3MBTL1SYKNPSR1
SCHEMBL30863382 0.80 ABCB1 (0.49) POLBL3MBTL1SYKMAPT
SCHEMBL18248126 0.79 POLB (0.43) POLBL3MBTL1SYKNTSR1MAPT
SCHEMBL18256542 0.79 POLB (0.43) POLBL3MBTL1SYKNTSR1MAPT

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
US-9669095-B2 Cyclosporin analogues for preventing or treating hepatitis C infection ENANTA PHARMACEUTICALS, INC. (US) 2017-06-06 US disclosed