SCHEMBL7045815

SCHEMBL7045815

O=C(CCCCc1ccc(-c2ccccc2)cc1)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 8/20 1.00
HDAC1 Q13547 16/20 0.97
ALOX5 P09917 1/20 0.78
HDAC8 Q9BY41 7/20 0.72
HDAC3 O15379 5/20 0.72
HDAC6 Q9UBN7 5/20 0.72
HDAC5 Q9UQL6 4/20 0.72
HDAC4 P56524 4/20 0.66
HDAC10 Q969S8 4/20 0.66
HDAC11 Q96DB2 4/20 0.66
HDAC9 Q9UKV0 4/20 0.66
HDAC7 Q8WUI4 4/20 0.66

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
SCHEMBL12889789 0.98 HDAC1 (1.00) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL7043051 0.95 HDAC2 (0.90) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL5020559 0.90 HDAC1 (0.96) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL5020670 0.88 HDAC1 (1.00) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL22190384 0.88 HDAC1 (1.00) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL5807174 0.88 HDAC1 (1.00) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL3844327 0.88 HDAC1 (1.00) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL8610138 0.88 HDAC1 (1.00) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL7046207 0.88 HDAC1 (0.79) HDAC2HDAC1ALOX5HDAC8HDAC3
SCHEMBL15522840 0.87 HDAC2 (0.77) HDAC2HDAC1ALOX5HDAC8HDAC3

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 7 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 claimed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP claimed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO claimed
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-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