SCHEMBL7318489

SCHEMBL7318489

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)O.Cc1cc(C)c(C(=O)OCC(=O)COC(=O)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 2/20 0.55
CTSL P07711 4/20 0.50
CTSB P07858 3/20 0.50
CTSS P25774 1/20 0.50
CTSK P43235 1/20 0.50
TACR1 P25103 2/20 0.48
MME P08473 1/20 0.48
ECE1 P42892 1/20 0.48
ALDH1A1 P00352 1/20 0.47
ALOX15 P16050 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
SCHEMBL7321639 0.93 CTSL (0.52) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7315282 0.93 CAPN1 (0.56) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7326049 0.92 CAPN1 (0.52) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7318406 0.91 CAPN1 (0.51) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7324547 0.90 ALDH1A1 (0.52) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7350904 0.89 CAPN1 (0.55) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7318474 0.89 CTSL (0.46) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7318468 0.89 CTSL (0.46) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7324267 0.88 CAPN1 (0.59) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL7323822 0.88 CTSL (0.48) 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 7 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
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