SCHEMBL7325949

SCHEMBL7325949

O=C(COc1c(F)c(F)c(F)c(F)c1F)COc1c(F)c(F)c(F)c(F)c1F.O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H](COCc1ccccc1)C(=O)O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 7/20 0.49
CTSB P07858 6/20 0.49
CTSS P25774 3/20 0.49
TACR1 P25103 2/20 0.49
CTSK P43235 1/20 0.48
ITGB3 P05106 1/20 0.47
ITGA2B P08514 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
SCHEMBL7315906 0.90 MMP12 (0.51) CTSLCTSBCTSSTACR1CTSK
SCHEMBL7319742 0.87 TACR1 (0.62) CTSLCTSBCTSSTACR1CTSK
SCHEMBL7316192 0.87 CAPN1 (0.57) CTSLCTSBCTSSTACR1CTSK
SCHEMBL7326532 0.86 HDAC8 (0.57) CTSLCTSBCTSSCTSKITGB3
SCHEMBL7320811 0.86 CAPN1 (0.62) CTSLCTSBCTSSCTSK
SCHEMBL7323257 0.85 ECE1 (0.56) CTSLCTSBCTSSTACR1ITGB3
SCHEMBL7326243 0.83 CTSL (0.56) CTSLCTSBCTSSTACR1CTSK
SCHEMBL7326797 0.83 TACR1 (0.56) CTSLCTSBCTSSTACR1CTSK
SCHEMBL7322777 0.83 CTSK (0.59) CTSLCTSBCTSSCTSK
SCHEMBL7317351 0.83 CTSL (0.50) CTSLCTSBCTSSTACR1CTSK

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 4 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 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