SCHEMBL7765671

SCHEMBL7765671

CCOC(=O)C1(C(=O)N[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)CO1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.56
KLKB1 P03952 5/20 0.52
ATM Q13315 2/20 0.51
ANPEP P15144 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ITGB1 P05556 1/20 0.50
ITGA4 P13612 1/20 0.50
ITGB7 P26010 1/20 0.50
MMP8 P22894 2/20 0.49
FCER2 P06734 3/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA3 P07451 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
CACNA1C Q13936 1/20 0.47
SCN9A Q15858 1/20 0.47

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
SCHEMBL7761865 0.91 L3MBTL1 (0.53) MMP1KLKB1ATMANPEPL3MBTL1
SCHEMBL7765664 0.90 MMP8 (0.51) MMP1L3MBTL1ITGB1ITGA4ITGB7
SCHEMBL7762771 0.90 MMP8 (0.51) MMP1L3MBTL1ITGB1ITGA4ITGB7
SCHEMBL7202935 0.89 MMP1 (0.53) MMP1ITGB1ITGA4ITGB7MMP8
SCHEMBL7406067 0.88 ITGB1 (0.61) ATML3MBTL1ITGB1ITGA4ITGB7
SCHEMBL7763984 0.87 MMP1 (0.55) MMP1ITGB1ITGA4ITGB7
SCHEMBL7761903 0.86 ITGB1 (0.52) MMP1ATML3MBTL1ITGB1ITGA4
SCHEMBL9229825 0.85 TACR1 (0.54) ATML3MBTL1ITGB1ITGA4ITGB7
SCHEMBL7406177 0.85 ITGB1 (0.48) MMP1KLKB1ATML3MBTL1ITGB1
SCHEMBL7405239 0.85 ITGB1 (0.50) MMP1ATML3MBTL1ITGB1ITGA4

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
EP-0808839-B1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO LTD (JP) 2001-05-23 EP disclosed
EP-0808839-A1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-11-26 EP disclosed