SCHEMBL7049002

SCHEMBL7049002

O=C(O)CCOc1ccc(-c2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.70
MMP3 P08254 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.65
LTA4H P09960 1/20 0.64
FFAR1 O14842 5/20 0.63
FFAR4 Q5NUL3 2/20 0.63
HDAC3 O15379 8/20 0.63
HDAC4 P56524 8/20 0.63
HDAC1 Q13547 8/20 0.63
HDAC7 Q8WUI4 8/20 0.63
HDAC2 Q92769 8/20 0.63
HDAC10 Q969S8 8/20 0.63
HDAC11 Q96DB2 8/20 0.63
HDAC8 Q9BY41 8/20 0.63
HDAC6 Q9UBN7 8/20 0.63
HDAC9 Q9UKV0 8/20 0.63
HDAC5 Q9UQL6 8/20 0.63
PPARA Q07869 2/20 0.56

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
SCHEMBL7049246 0.91 FFAR4 (0.75) MMP3LTA4HFFAR1FFAR4HDAC3
SCHEMBL38674 0.88 L3MBTL1 (0.68) MMP2L3MBTL1LTA4HFFAR1PPARA
SCHEMBL7515225 0.87 HDAC3 (0.77) MMP3LTA4HFFAR1FFAR4HDAC3
SCHEMBL1007408 0.87 HDAC3 (0.77) MMP3LTA4HFFAR1FFAR4HDAC3
SCHEMBL3381443 0.87 HDAC3 (0.77) MMP3LTA4HFFAR1FFAR4HDAC3
SCHEMBL10877978 0.86 L3MBTL1 (0.66) MMP2L3MBTL1LTA4HFFAR1PPARA
SCHEMBL14413930 0.85 MMP3 (0.66) MMP2MMP3L3MBTL1LTA4HFFAR1
SCHEMBL21993318 0.85 MMP3 (0.66) MMP2MMP3LTA4HFFAR1FFAR4
SCHEMBL10583018 0.85 LTA4H (0.69) MMP2L3MBTL1LTA4HFFAR1FFAR4
SCHEMBL28539082 0.84 L3MBTL1 (0.63) MMP2L3MBTL1LTA4HFFAR1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874808-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 EP disclosed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP disclosed
US-5696050-A APPLYING TO CROP PLANT, SEED OR SURROUNDING SOIL OR WATER ANTIDOTAL AMOUNT OF PLANT SAFENING AGENT AMERICAN CYANAMID COMPANY (US) 1997-12-09 US disclosed
US-5665777-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1997-09-09 US disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO disclosed
EP-0613618-B1 Method for safening herbicides in crops using substituted benzopyran and tetrahydronaphthalene compounds AMERICAN CYANAMID CO (US) 1997-04-16 EP disclosed
US-5516918-A PLANT SAFTENING AGENTS USING BENZOPYRAN-4-ACETIC ACIDS OR BENZOTHIOPYRAN-4-ACETIC ACIDS AMERICAN CYANAMID COMPANY (US) 1996-05-14 US disclosed
US-5407897-A Plant safening agents AMERICAN CYANAMID COMPANY (US) 1995-04-18 US disclosed
EP-0613618-A1 Method for safening herbicides in crops using substituted benzopyran and tetrahydronaphthalene compounds AMERICAN CYANAMID COMPANY (US) 1994-09-07 EP disclosed