SCHEMBL7355459

SCHEMBL7355459

O=C(NO)C(Cc1ccccc1)C(=O)Nc1ccc(-c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP8 P22894 3/20 0.60
▸ MME P08473 1/20 0.58
▸ MMP2 P08253 1/20 0.56
▸ MMP9 P14780 1/20 0.56
▸ MEN1 O00255 1/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ KMT2A Q03164 1/20 0.52

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
SCHEMBL8507779 0.86 MMP8 (0.62) MMP8MMEMMP2MMP9
SCHEMBL8507827 0.85 NPY5R (0.56) MMP8MME
SCHEMBL14853314 0.84 HDAC1 (0.61) MMP8MMEMEN1NPC1RAB9A
SCHEMBL8508106 0.81 ERAP2 (0.60) MMP8
SCHEMBL7354597 0.80 NPY5R (0.56) MMP8MME
SCHEMBL8509498 0.80 MMP8 (0.55) MMP8MME
SCHEMBL28045650 0.79 ALDH1A1 (0.56) MEN1NPC1RAB9AKMT2A
SCHEMBL4909594 0.79 MMP8 (0.72) MMP8MME
SCHEMBL4523811 0.74 ROCK2 (0.62) MEN1NPC1RAB9AKMT2A
SCHEMBL4526393 0.74 ROCK2 (0.62) MEN1NPC1RAB9AKMT2A

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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