SCHEMBL8308565

SCHEMBL8308565

CCOC(=O)[C@@H]1CN1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.51
FPR2 P25090 2/20 0.51
CTSB P07858 2/20 0.51
CTSS P25774 1/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MMP8 P22894 1/20 0.46
MMP1 P03956 1/20 0.46
MMP3 P08254 1/20 0.46
POLB P06746 1/20 0.45
GFER P55789 1/20 0.45
GAA P10253 1/20 0.45
P2RY12 Q9H244 1/20 0.45
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL7362837 0.82 FPR2 (0.52) CTSLFPR2CTSBL3MBTL1MMP8
SCHEMBL8310281 0.82 CYP3A4 (0.50) CTSSPOLBGAAKMT2AALDH1A1
SCHEMBL9087713 0.82 CAPN1 (0.52) CTSLFPR2CTSBL3MBTL1MMP8
SCHEMBL9087720 0.76 ITGB1 (0.49) CTSLFPR2CTSBMMP8MMP1
SCHEMBL9087719 0.75 ITGA4 (0.50) FPR2L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL7268468 0.74 POLB (0.76) CTSLCTSBCTSSATML3MBTL1
SCHEMBL7268474 0.74 POLB (0.76) CTSLCTSBCTSSATML3MBTL1
SCHEMBL16254296 0.74 MMP8 (0.62) CTSLCTSSMMP8MMP1MMP3
SCHEMBL20176845 0.74 MMP8 (0.62) CTSLCTSSMMP8MMP1MMP3
SCHEMBL7354191 0.73 FPR2 (0.54) FPR2ATML3MBTL1MMP1MMP3

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-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