SCHEMBL7230599

SCHEMBL7230599

O=C(NO)C(CCCN1C(=O)c2ccccc2C1=O)COc1ccc(-c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 1.00
MMP9 P14780 13/20 1.00
MMP3 P08254 10/20 1.00
MMP13 P45452 10/20 1.00
MMP1 P03956 7/20 0.88
HDAC7 Q8WUI4 5/20 0.53
HDAC1 Q13547 4/20 0.53
ADAM17 P78536 2/20 0.51
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MMP14 P50281 2/20 0.46
ADAM10 O14672 1/20 0.46

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
SCHEMBL7225679 0.89 MMP2 (0.80) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7233440 0.84 MMP2 (0.81) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7230149 0.83 MMP2 (0.70) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7229104 0.82 MMP2 (0.79) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7224224 0.79 MMP2 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7224858 0.77 MMP2 (0.70) MMP2MMP9MMP3MMP13MMP1
SCHEMBL10674350 0.76 RAB9A (0.82) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7224271 0.75 MMP2 (0.67) MMP2MMP9MMP3MMP13MMP1
SCHEMBL8483472 0.74 RAB9A (0.74) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7222497 0.74 MMP2 (0.64) MMP2MMP9MMP3MMP13MMP1

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-6605604-B1 Tumour necrosis factor alpha release inhibitors; efficiency treatment of cancers, rheumatic diseases, arthritis, ulcers, atherosclerosis, asthma LES LABORATOIRES SERVIER (FR) 2003-08-12 US disclosed
EP-1091937-A1 CARBOXYLIC AND HYDROXAMIC ACID COMPOUNDS INHIBITING METALLOPROTEASES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 2001-04-18 EP disclosed
WO-2000000473-A1 CARBOXYLIC AND HYDROXAMIC ACID COMPOUNDS INHIBITING METALLOPROTEASES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 2000-01-06 WO disclosed