SCHEMBL7354597

SCHEMBL7354597

O=C(NO)C(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 3/20 0.56
▸ S1PR1 P21453 1/20 0.53
▸ MMP8 P22894 1/20 0.51
▸ FNTA P49354 1/20 0.50
▸ FNTB P49356 1/20 0.50
▸ MME P08473 1/20 0.50
▸ PNLIP P16233 1/20 0.50
▸ PPARG P37231 3/20 0.49
▸ PPARA Q07869 3/20 0.49

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
SCHEMBL8507827 0.92 NPY5R (0.56) NPY5RMMP8MME
SCHEMBL8508382 0.88 MMP8 (0.53) NPY5RS1PR1MMP8FNTAFNTB
SCHEMBL8509498 0.88 MMP8 (0.55) NPY5RMMP8FNTAFNTBMME
SCHEMBL1374838 0.82 NPY5R (0.58) NPY5RS1PR1FNTAFNTBPPARG
SCHEMBL1374841 0.82 NPY5R (0.58) NPY5RS1PR1FNTAFNTBPPARG
SCHEMBL7355459 0.80 MMP8 (0.60) MMP8MME
SCHEMBL7354557 0.80 MMP8 (0.58) NPY5RS1PR1MMP8
SCHEMBL8507870 0.80 ANPEP (0.49) NPY5RS1PR1FNTAFNTB
SCHEMBL8508837 0.79 FNTA (0.56) NPY5RFNTAFNTBPNLIP
SCHEMBL2610069 0.77 KMT2A (0.54) —

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-1009736-A1 MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS Roche Diagnostics GmbH (DE) 2000-06-21 — — EP disclosed
EP-0911319-A1 Malonic acid based matrix metalloproteinase inhibitors Roche Diagnostics GmbH (DE) 1999-04-28 — — EP disclosed
WO-1999011608-A1 MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS ROCHE DIAGNOSTICS GMBH (DE) 1999-03-11 — — WO disclosed
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