SCHEMBL7433854

SCHEMBL7433854

COc1ccc2[nH]cc(C[C@@H](NC(=O)OCc3ccccc3)C(=O)O)c2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.66
MEN1 O00255 3/20 0.66
SIRT2 Q8IXJ6 1/20 0.62
SIRT1 Q96EB6 1/20 0.62
SIRT3 Q9NTG7 1/20 0.62
MAPT P10636 4/20 0.61
LMNA P02545 1/20 0.61
ITGB2 P05107 1/20 0.58
ICAM1 P05362 1/20 0.58
ITGAL P20701 1/20 0.58
TACR1 P25103 2/20 0.58
NMBR P28336 2/20 0.58
GAA P10253 1/20 0.58
HTT P42858 1/20 0.58
HSP90AA1 P07900 1/20 0.56
HSP90AB1 P08238 1/20 0.56
LTA4H P09960 1/20 0.56
PLA2G2A P14555 1/20 0.56
MME P08473 2/20 0.54
ECE1 P42892 2/20 0.54

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
SCHEMBL10899901 0.89 KMT2A (0.65) KMT2AMEN1SIRT2SIRT1SIRT3
SCHEMBL10968952 0.89 KMT2A (0.65) KMT2AMEN1SIRT2SIRT1SIRT3
SCHEMBL11866933 0.89 KMT2A (0.74) KMT2AMAPTLMNAITGB2ICAM1
SCHEMBL16634516 0.88 MAPT (0.62) KMT2AMEN1MAPTLMNATACR1
SCHEMBL7436159 0.88 NMBR (0.62) KMT2AMEN1MAPTLMNANMBR
SCHEMBL3036857 0.88 NMBR (0.62) KMT2AMEN1MAPTLMNANMBR
SCHEMBL10899582 0.88 NMBR (0.62) KMT2AMEN1MAPTLMNANMBR
SCHEMBL16645245 0.86 MAPT (0.61) KMT2AMEN1SIRT2SIRT1SIRT3
SCHEMBL17938406 0.86 MAPT (0.61) KMT2AMEN1SIRT2SIRT1SIRT3
SCHEMBL8197468 0.86 TGM2 (0.65) KMT2AMEN1MAPTLMNAITGB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0916671-B1 Metalloprotease inhibitors, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-01-30 EP disclosed
US-6066633-A PREVENT TISSUE DEGRADATION ADIR ET COMPAGNIE (FR) 2000-05-23 US disclosed
EP-0916671-A1 Metalloprotease inhibitors, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-05-19 EP disclosed