SCHEMBL8972198

SCHEMBL8972198

CCC(C)C(NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(OC)OC

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 13/20 0.65
CTSL P07711 6/20 0.60
CTSB P07858 4/20 0.60
CTSS P25774 3/20 0.60
CAPN1 P07384 2/20 0.57
CAPN2 P17655 1/20 0.56

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
SCHEMBL8972993 0.85 CTSK (0.70) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL8972996 0.85 CTSK (0.70) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL8972715 0.84 CTSK (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL31512942 0.84 CTSK (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL31512934 0.84 CTSK (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL31512923 0.84 CTSK (0.69) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL8971578 0.83 CTSK (0.67) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL6666949 0.82 CTSK (0.77) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL7163409 0.82 CTSK (0.75) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL26292318 0.82 CTSK (0.75) CTSKCTSLCTSBCTSSCAPN1

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-0543310-B1 Dipeptide derivative and prophylactic and therapeutic agent for bone diseases containing the same SUNTORY LTD (JP) 1996-03-27 EP disclosed
US-5395824-A Dipeptide derivative and prophylactic and therapeutic agent for bone diseases containing the same SUNTORY LIMITED (JP) 1995-03-07 US disclosed