SCHEMBL8933947

SCHEMBL8933947

CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N(CC)CC

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.57
CTSS P25774 3/20 0.57
PSENEN Q9NZ42 1/20 0.45
CA2 P00918 3/20 0.44
CA1 P00915 1/20 0.43
CA7 P43166 1/20 0.43
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL8933949 1.00 CTSK (0.57) CTSKCTSSPSENENCA2CA1
SCHEMBL19981634 0.88 CTSK (0.52) CTSKCTSSPSENENCA2CA1
SCHEMBL12878138 0.87 CTSK (0.56) CTSKCTSSPSENENCA2CA1
SCHEMBL14779115 0.86 CTSK (0.58) CTSKCTSSPSENENCA2CA1
SCHEMBL1204596 0.82 CTSS (0.54) CTSKCTSSPSENENCA2CA1
SCHEMBL1204594 0.82 CTSS (0.54) CTSKCTSSPSENENCA2CA1
SCHEMBL12189209 0.82 CTSS (0.54) CTSKCTSSPSENENCA2CA1
SCHEMBL20028616 0.82 CTSS (0.54) CTSKCTSSPSENENCA2CA1
SCHEMBL24246252 0.81 CTSK (0.53) CTSKCTSSPSENENCA2CA1
SCHEMBL16410975 0.81 CTSK (0.53) CTSKCTSSPSENENCA2CA1

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
JP-8041043-A None JP disclosed
JP-H0841043-A EPOXYSUCCINIC ACID DERIVATIVE TAISHO PHARMACEUT CO LTD 1996-02-13 JP disclosed