SCHEMBL7103473

SCHEMBL7103473

O=C(O)[C@H](Cc1c[nH]c2ccccc12)NP(=O)(O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 3/20 0.65
ITGB2 P05107 7/20 0.64
ICAM1 P05362 7/20 0.64
ITGAL P20701 7/20 0.64
ALOX15 P16050 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.60
ERAP2 Q6P179 1/20 0.60
KDM4E B2RXH2 2/20 0.59
MAPT P10636 2/20 0.59
APAF1 O14727 1/20 0.59
POLB P06746 1/20 0.59
RECQL P46063 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
MEN1 O00255 1/20 0.59
LMNA P02545 1/20 0.59
MPO P05164 1/20 0.59
TSHR P16473 1/20 0.59
BLM P54132 1/20 0.59
PMP22 Q01453 1/20 0.59
KMT2A Q03164 1/20 0.59

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
SCHEMBL7103470 1.00 ACE (0.65) ACEITGB2ICAM1ITGALALOX15
SCHEMBL5054823 0.87 ACE (0.58) ACEITGB2ICAM1ITGALALOX15
SCHEMBL15902638 0.86 MMP9 (0.60) ACEITGB2ICAM1ITGALALOX15
SCHEMBL4861231 0.86 MMP9 (0.60) ACEITGB2ICAM1ITGALALOX15
SCHEMBL29562240 0.86 ECE1 (0.71) ACEERAP2
SCHEMBL14503216 0.86 ECE1 (0.71) ACEERAP2
SCHEMBL8530802 0.85 ACE (0.63) ACEITGB2ICAM1ITGALALOX15
SCHEMBL8530804 0.85 ACE (0.63) ACEITGB2ICAM1ITGALALOX15
SCHEMBL3381353 0.85 ALOX15 (0.67) ACEITGB2ICAM1ITGALALOX15
SCHEMBL3381356 0.85 ALOX15 (0.67) ACEITGB2ICAM1ITGALALOX15

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-1019434-B1 INHIBITORS OF METALLOPROTEINASES, THEIR THERAPEUTIC USE, AND PROCESS FOR THE PRODUCTION OF THE STARTING COMPOUND IN THEIR SYNTHESIS POLIFARMA SPA (IT) 2003-10-01 EP disclosed
EP-1019434-A2 INHIBITORS OF METALLOPROTEINASES, THEIR THERAPEUTIC USE, AND PROCESS FOR THE PRODUCTION OF THE STARTING COMPOUND IN THEIR SYNTHESIS POLIFARMA S.p.A. (IT) 2000-07-19 EP disclosed
WO-1999003878-A3 INHIBITORS OF METALLOPROTEINASES, THEIR THERAPEUTIC USE, AND PROCESS FOR THE PRODUCTION OF THE STARTING COMPOUND IN THEIR SYNTHESIS POLIFARMA SPA (IT) 1999-04-01 WO disclosed
WO-1999003878-A2 INHIBITORS OF METALLOPROTEINASES, THEIR THERAPEUTIC USE, AND PROCESS FOR THE PRODUCTION OF THE STARTING COMPOUND IN THEIR SYNTHESIS POLIFARMA S.P.A. (IT) 1999-01-28 WO disclosed