SCHEMBL7042845

SCHEMBL7042845

CC(CC(=O)O)Oc1ccc(-c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.62
GAA P10253 1/20 0.62
CYP2C9 P11712 1/20 0.62
PKM P14618 1/20 0.62
CYP2C19 P33261 1/20 0.62
MAPT P10636 2/20 0.57
PPARG P37231 9/20 0.51
PPARA Q07869 7/20 0.51
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
MMP12 P39900 1/20 0.48
LTA4H P09960 1/20 0.47
SLC6A3 Q01959 1/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL1418060 0.89 MTNR1A (0.59) CYP1A2GAACYP2C9PKMCYP2C19
SCHEMBL7115655 0.83 FFAR1 (0.50) CYP1A2GAACYP2C9PKMCYP2C19
SCHEMBL28924876 0.83 MMP2 (0.56) GAAMAPTMMP12
SCHEMBL21991878 0.82 MTNR1A (0.58) PPARGPPARAMTNR1AMTNR1B
SCHEMBL8480831 0.82 MTNR1A (0.44) CYP1A2GAACYP2C9PKMCYP2C19
SCHEMBL23606001 0.82 L3MBTL1 (0.49) GAAMAPTPPARGPPARAMTNR1A
SCHEMBL5507885 0.81 PTPN7 (0.56) CYP1A2GAAMAPTPPARGPPARA
SCHEMBL2108300 0.81 ALDH1A1 (0.50) GAACYP2C9CYP2C19MAPTPPARG
SCHEMBL10958161 0.81 LDHA (0.55) MAPTPPARGPPARAMTNR1AMTNR1B
SCHEMBL9819006 0.81 KMT2A (0.52) CYP1A2GAACYP2C9CYP2C19PPARG

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 4 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-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