SCHEMBL7315944

SCHEMBL7315944

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)O.Cc1c(C)c(C(=O)OCC=O)c(C)c(C)c1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 2/20 0.54
CTSL P07711 4/20 0.51
CTSB P07858 4/20 0.51
CTSS P25774 1/20 0.49
CTSK P43235 1/20 0.49
TACR1 P25103 2/20 0.48

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
SCHEMBL7315939 0.89 CAPN1 (0.55) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7434411 0.87 CAPN1 (0.55) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL10967811 0.83 CAPN1 (0.72) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7281206 0.83 CAPN1 (0.72) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL31397615 0.83 CAPN1 (0.72) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL5484209 0.83 CAPN1 (0.72) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL9088735 0.83 CAPN1 (0.72) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7313795 0.79 CAPN1 (0.67) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7316923 0.79 CAPN1 (0.67) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL4504085 0.79 CAPN1 (0.67) CAPN1CTSLCTSBCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272671-B1 Aryloxy and arylacyloxy methyl ketones as thiol protease inhibitors SANDOZ LTD (CH) 1994-03-16 EP claimed
US-5158936-A Treating or prevention of tissue damage, inflammation, bone resporpption and muscular dystrophy SYNTEX (U.S.A.) INC. (US) 1992-10-27 US claimed
US-5055451-A Prevent tissue damage SYNTEX INC. (US) 1991-10-08 US claimed
EP-0272671-A2 Aryloxy and arylacyloxy methyl ketones as thiol protease inhibitors SANDOZ LTD. (CH) 1988-06-29 EP claimed
EP-0272671-B1 Aryloxy and arylacyloxy methyl ketones as thiol protease inhibitors SANDOZ LTD (CH) 1994-03-16 EP disclosed
US-5158936-A Treating or prevention of tissue damage, inflammation, bone resporpption and muscular dystrophy SYNTEX (U.S.A.) INC. (US) 1992-10-27 US disclosed
US-5055451-A Prevent tissue damage SYNTEX INC. (US) 1991-10-08 US disclosed
EP-0272671-A2 Aryloxy and arylacyloxy methyl ketones as thiol protease inhibitors SANDOZ LTD. (CH) 1988-06-29 EP disclosed