SCHEMBL1250468

SCHEMBL1250468

O=C(N[C@@H]1C[C@@H](C(=O)O)N(C(=O)Cl)C1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.62
ANPEP P15144 5/20 0.51
AGTR2 P50052 4/20 0.49
GRM5 P41594 1/20 0.49
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
CTSK P43235 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 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
SCHEMBL1250469 1.00 MMP2 (0.62) MMP2ANPEPAGTR2GRM5CTSL
SCHEMBL1250470 1.00 MMP2 (0.62) MMP2ANPEPAGTR2GRM5CTSL
SCHEMBL1250968 0.91 MMP2 (0.62) MMP2ANPEPAGTR2GRM5CTSL
SCHEMBL1250974 0.91 MMP2 (0.62) MMP2ANPEPAGTR2GRM5CTSL
SCHEMBL1250970 0.91 MMP2 (0.62) MMP2ANPEPAGTR2GRM5CTSL
SCHEMBL1250594 0.89 MMP2 (0.53) MMP2GRM5CTSLCTSBCTSK
SCHEMBL1250597 0.89 MMP2 (0.53) MMP2GRM5CTSLCTSBCTSK
SCHEMBL1250590 0.89 MMP2 (0.53) MMP2GRM5CTSLCTSBCTSK
SCHEMBL2511332 0.86 MMP2 (0.83) MMP2ANPEPGRM5CTSLCTSB
SCHEMBL2525161 0.86 MMP2 (0.57) MMP2ANPEPAGTR2CTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2279737-B1 Heterocyclic compounds that are active as beta lactamase inhibitors NOVEXEL (FR) 2012-10-31 EP disclosed
EP-2279737-A1 Heterocyclic compounds that are active as beta lactamase inhibitors NOVEXEL (FR) 2011-02-02 EP disclosed
EP-1480644-B1 NOVEL HETEROCYCLIC COMPOUNDS WHICH ARE ACTIVE AS INHIBITORS OF BETA+LACTAMASES NOVEXEL (FR) 2010-10-13 EP disclosed
EP-1307457-B1 AZABICYCLIC COMPOUNDS, PREPARATION THEREOF AND USE AS MEDICINES, IN PARTICULAR AS ANTIBACTERIAL AGENTS AVENTIS PHARMA SA (FR) 2004-04-07 EP disclosed
EP-1307457-A1 AZABICYCLIC COMPOUNDS, PREPARATION THEREOF AND USE AS MEDICINES, IN PARTICULAR AS ANTIBACTERIAL AGENTS Aventis Pharma S.A. (FR) 2003-05-07 EP disclosed
WO-2002010172-A1 AZABICYCLIC COMPOUNDS, PREPARATION THEREOF AND USE AS MEDICINES, IN PARTICULAR AS ANTIBACTERIAL AGENTS AVENTIS PHARMA SA (FR) 2002-02-07 WO disclosed