SCHEMBL7047544

SCHEMBL7047544

O=C(O)C(O)COc1ccccc1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
ADRB2 P07550 3/20 0.54
ADRB1 P08588 1/20 0.54
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
RXRG P48443 1/20 0.51
KDM4E B2RXH2 6/20 0.50
ALDH1A1 P00352 5/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPK1 P28482 3/20 0.49
HTT P42858 3/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 2/20 0.49
USP2 O75604 1/20 0.49
TP53 P04637 2/20 0.48
ADRA1A P35348 1/20 0.48
CYP1A2 P05177 1/20 0.48

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
SCHEMBL7048966 0.88 ADRB2 (0.52) L3MBTL1TDP1ADRB2ADRB1RXRA
SCHEMBL6230392 0.86 L3MBTL1 (0.58) L3MBTL1TDP1ADRB2ADRB1RXRA
SCHEMBL1151623 0.79 ADRB2 (0.56) L3MBTL1TDP1ADRB2ADRB1RXRA
SCHEMBL10408230 0.79 ADRB2 (0.64) L3MBTL1TDP1ADRB2ADRB1RXRA
SCHEMBL10813524 0.79 GAA (0.50) L3MBTL1ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL12473595 0.79 ADRB2 (0.61) L3MBTL1TDP1ADRB2ADRB1KDM4E
SCHEMBL23973559 0.78 KDM4E (0.60) ADRB2ADRB1RXRARXRBRXRG
SCHEMBL5076009 0.78 LMNA (0.60) L3MBTL1RXRAKDM4ESMN1; SMN2KMT2A
SCHEMBL15677631 0.77 ADRB2 (0.65) L3MBTL1TDP1ADRB2ADRB1KDM4E
SCHEMBL772820 0.77 ADRB2 (0.61) L3MBTL1TDP1ADRB2ADRB1KDM4E

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