SCHEMBL7177702

SCHEMBL7177702

CCCCCCOc1ccc(NC(C(=O)NC(C(=O)Nc2ccccn2)C(C)(C)C)C(O)C(=O)NO)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 12/20 0.50
MMP1 P03956 11/20 0.50
MMP9 P14780 4/20 0.50
MMP2 P08253 1/20 0.50
MMP7 P09237 1/20 0.50
PPARG P37231 1/20 0.44
FAAH O00519 6/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 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
SCHEMBL7170041 0.97 MMP3 (0.52) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7173112 0.93 MMP1 (0.44) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7177674 0.90 MMP1 (0.46) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7177123 0.87 MMP3 (0.57) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7178504 0.86 MMP3 (0.45) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7172740 0.86 MMP3 (0.52) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7172185 0.84 MMP3 (0.55) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7178513 0.83 MMP1 (0.44) MMP3MMP1MMP9MMP2
SCHEMBL7192046 0.83 MMP3 (0.52) MMP3MMP1MMP9MMP2MMP7
SCHEMBL7178370 0.79 PPARG (0.46) MMP3MMP1MMP9PPARGMEN1

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
US-6576628-B1 Matrix metalloprotease inhibitors; arthritis, corneal ulcers, arteriosclerosis ROCHE DIAGNOSTICS GMBH (DE) 2003-06-10 US disclosed
EP-1005449-B1 3-ARYL-SUCCINAMIDO-HYDROXAMIC ACIDS, METHODS FOR PRODUCING SAID ACIDS AND MEDICAMENTS CONTAINING THE SAME ROCHE DIAGNOSTICS GMBH (DE) 2002-10-30 EP disclosed
EP-0897908-A1 3-Aryl-succinamido-hydroxamic acids, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1999-02-24 EP disclosed