SCHEMBL7921333

SCHEMBL7921333

CCN[C@@H](CC)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.37
BIRC2 Q13490 1/20 0.37
POLB P06746 1/20 0.36
ZDHHC7 Q9NXF8 1/20 0.35
TAS1R3 Q7RTX0 2/20 0.35
TAS1R1 Q7RTX1 2/20 0.35
ATM Q13315 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
FOLH1 Q04609 1/20 0.33
CA14 Q9ULX7 1/20 0.32
MIF P14174 1/20 0.32

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
SCHEMBL10296136 1.00 CA1 (0.42) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL21309845 0.84 MME (0.40) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL23375007 0.84 MME (0.40) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL23374703 0.84 MME (0.40) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL23374708 0.82 CA1 (0.35) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL8657490 0.82 CA1 (0.44) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL24929855 0.80 TAS1R3 (0.49) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL13921451 0.80 CA1 (0.39) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL28054767 0.80 CA1 (0.39) CA1CA2SMN1; SMN2BIRC2POLB
SCHEMBL14420244 0.80 CA1 (0.38) CA1CA2SMN1; SMN2BIRC2POLB

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-2010036551-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-04-01 WO disclosed