SCHEMBL7354485

SCHEMBL7354485

CCOC(=O)[C@H]1N[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.43
CTSL P07711 4/20 0.43
CTSB P07858 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
CTSK P43235 4/20 0.42
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
ATM Q13315 1/20 0.41
CAPN1 P07384 1/20 0.40

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
SCHEMBL7361188 0.91 BACE1 (0.45) CTSSCTSLCTSBL3MBTL1CTSK
SCHEMBL7359406 0.89 MMP1 (0.49) L3MBTL1ATM
SCHEMBL7353746 0.87 MMP9 (0.55) CTSLL3MBTL1
SCHEMBL7361887 0.87 MMP9 (0.55) CTSLL3MBTL1
SCHEMBL7363926 0.87 L3MBTL1 (0.47) L3MBTL1
SCHEMBL7354151 0.85 CTSL (0.46) CTSSCTSLCTSBL3MBTL1CTSK
SCHEMBL7355755 0.85 L3MBTL1 (0.42) CTSSCTSLCTSBL3MBTL1CTSK
SCHEMBL7359283 0.85 CAPN9 (0.49) CTSLCTSBL3MBTL1CAPN1
SCHEMBL7362797 0.85 SRC (0.47) L3MBTL1
SCHEMBL7354780 0.85 LMNA (0.49) L3MBTL1

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-0753003-B1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-06-16 EP disclosed
US-5668128-A INHIBITORS OF THIOL PROTEASE, PROPHYLAXIS AND TREATMENT OF BONE DISEASES, OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-09-16 US disclosed
EP-0753003-A1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-01-15 EP disclosed
WO-1995028416-A1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-26 WO disclosed