SCHEMBL11028528

SCHEMBL11028528

CCOP(=O)(OCC)C(Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.58
HDAC8 Q9BY41 3/20 0.58
TACR1 P25103 2/20 0.53
PLAU P00749 1/20 0.52
PLAT P00750 1/20 0.52
CTSL P07711 2/20 0.52
CTSK P43235 2/20 0.52
CTSB P07858 1/20 0.52
CTSS P25774 1/20 0.52
ITGB3 P05106 5/20 0.51
ITGA2B P08514 5/20 0.51
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51

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
SCHEMBL11126448 0.90 BCL2 (0.59) HDAC8CTSLCTSKCTSBCTSS
SCHEMBL10824232 0.86 MME (0.50) F2HDAC8CTSBMMP9MMP8
SCHEMBL14376753 0.84 F2 (0.63) F2PLAUPLAT
SCHEMBL11028529 0.82 HDAC8 (0.51) F2HDAC8TACR1CTSLCTSK
SCHEMBL11034687 0.81 MME (0.51) HDAC8
SCHEMBL282500 0.81 BCL2 (0.52) F2HDAC8PLAUPLAT
SCHEMBL11126449 0.80 BCL2 (0.49) HDAC8CTSKCTSS
SCHEMBL10784747 0.80 CAPN1 (0.64) HDAC8CTSLCTSKCTSBCTSS
SCHEMBL9483283 0.79 PPARG (0.67) HDAC8CTSLCTSKCTSBCTSS
SCHEMBL9483288 0.79 PPARG (0.67) HDAC8CTSLCTSKCTSBCTSS

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-0061172-B1 PHOSPHORUS-CONTAINING OLIGOPEPTIDES, PROCESSES FOR PREPARATION THEREOF AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME KYOWA HAKKO KOGYO CO., LTD. (JP) 1985-06-19 EP disclosed
EP-0061172-A1 Phosphorus-containing oligopeptides, processes for preparation thereof and a pharmaceutical composition containing the same KYOWA HAKKO KOGYO CO., LTD. (JP) 1982-09-29 EP disclosed