SCHEMBL7817060

SCHEMBL7817060

CN(C(=O)OC(C)(C)C)[C@H]1CC[C@H](CCO)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.40
LSS P48449 3/20 0.39
ASGR1 P07306 1/20 0.39
NR1H2 P55055 1/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35
KAT6A Q92794 1/20 0.35
KAT8 Q9H7Z6 1/20 0.35
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4D Q6B0I6 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
CA14 Q9ULX7 1/20 0.31
GPR119 Q8TDV5 1/20 0.30
ACACB O00763 1/20 0.30
ACACA Q13085 1/20 0.30
HDAC1 Q13547 1/20 0.30

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
SCHEMBL4806606 0.91 LSS (0.42) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL4806612 0.91 LSS (0.42) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL4805126 0.89 LSS (0.44) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL4805133 0.89 LSS (0.44) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL23696267 0.89 NR1H2 (0.43) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL4805517 0.89 NR1H2 (0.43) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL343692 0.89 NR1H2 (0.43) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL4803156 0.88 LSS (0.46) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL4803152 0.88 LSS (0.46) HSD11B1LSSASGR1NR1H2JAK2
SCHEMBL190837 0.86 HSD11B1 (0.47) HSD11B1ASGR1JAK2JAK1JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0798298-B1 THIAZOLIDINONE OR OXAZOLIDINONE DERIVATIVES TO TREAT ANGINA PECTORIS OR COMPOSITIONS CONTAINING THE SAME AS ACTIVE INGREDIENT SANKYO CO (JP) 2001-08-08 EP disclosed
US-5843973-A Thiazolidinone compounds and composition for angina pectoris comprising the compounds as an active ingredient SANKYO COMPANY, LIMITED (JP) 1998-12-01 US disclosed
EP-0798298-A1 THIAZOLIDINONE COMPOUNDS OR ANGINA PECTORIS REMEDY OR PREVENTIVE CONTAINING THE SAME AS ACTIVE INGREDIENT SANKYO COMPANY LIMITED (JP) 1997-10-01 EP disclosed