SCHEMBL7817062

SCHEMBL7817062

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

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACACB O00763 9/20 0.51
ACACA Q13085 5/20 0.51
KMT2A Q03164 2/20 0.50
DRD2 P14416 2/20 0.49
TDP1 Q9NUW8 1/20 0.47
EPHX1 P07099 1/20 0.43
CKS1B P61024 1/20 0.42
SKP1 P63208 1/20 0.42
SKP2 Q13309 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL7817058 1.00 ACACB (0.51) ACACBACACAKMT2ADRD2TDP1
SCHEMBL3942686 0.91 KMT2A (0.56) ACACBACACAKMT2ADRD2TDP1
SCHEMBL3816616 0.91 KMT2A (0.56) ACACBACACAKMT2ADRD2TDP1
SCHEMBL4377073 0.91 KMT2A (0.56) ACACBACACAKMT2ADRD2TDP1
SCHEMBL190838 0.91 KMT2A (0.56) ACACBACACAKMT2ADRD2TDP1
SCHEMBL7820029 0.90 TDP1 (0.53) ACACBACACAKMT2ADRD2TDP1
SCHEMBL7818634 0.89 TDP1 (0.55) ACACBACACAKMT2ADRD2TDP1
SCHEMBL7816031 0.88 KMT2A (0.51) ACACBACACAKMT2ADRD2TDP1
SCHEMBL1491414 0.88 KMT2A (0.51) ACACBACACAKMT2ADRD2TDP1
SCHEMBL3945277 0.88 KMT2A (0.51) ACACBACACAKMT2ADRD2TDP1

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