SCHEMBL7609036

SCHEMBL7609036

NCN(O)C(=O)c1ccccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.51
KDM4E B2RXH2 5/20 0.50
HPGD P15428 5/20 0.50
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 3/20 0.50
MAPT P10636 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
CA1 P00915 2/20 0.47
CA9 Q16790 2/20 0.47
CA12 O43570 1/20 0.47
CA2 P00918 1/20 0.47
HMGB1 P09429 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA7 P43166 1/20 0.47
NAPRT Q6XQN6 1/20 0.47
CA14 Q9ULX7 1/20 0.47
GAA P10253 2/20 0.42
MPO P05164 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL1436049 0.78 TSHR (0.72) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL9760694 0.77 KDM4E (0.56) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL750649 0.75 KDM4E (0.58) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL7866805 0.74 KDM4E (0.52) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL1436159 0.74 KDM4E (0.52) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL1822372 0.73 TSHR (0.47) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL11328033 0.72 KDM4E (0.54) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL549420 0.72 KDM4E (0.54) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL2722233 0.72 KDM4E (0.54) TSHRKDM4EHPGDALDH1A1HSD17B10
SCHEMBL29287849 0.72 KDM4E (0.54) TSHRKDM4EHPGDALDH1A1HSD17B10

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-0920413-B1 BORONIC COMPOUND COMPLEXING REAGENTS AND COMPLEXES PROLINX INC (US) 2002-11-13 EP disclosed
EP-0920413-A1 BORONIC COMPOUND COMPLEXING REAGENTS AND COMPLEXES PROLINX, INC. (US) 1999-06-09 EP disclosed
EP-0915832-A1 BORONIC COMPOUND COMPLEXING REAGENTS AND HIGHLY STABLE COMPLEXES PROLINX, INC. (US) 1999-05-19 EP disclosed
US-5872224-A Boronic compound complexing reagents and highly stable complexes PROLINX, INC. (US) 1999-02-16 US disclosed
US-5859210-A Boronic compound complexing reagents and complexes PROLINX, INC. (US) 1999-01-12 US disclosed
US-5837878-A Boronic compound complexing reagents and highly stable complexes PROLINX, INC. (US) 1998-11-17 US disclosed
US-5744627-A Boronic compound complexing reagents and complexes PROLINX, INC. (US) 1998-04-28 US disclosed
WO-1998005627-A1 BORONIC COMPOUND COMPLEXING REAGENTS AND HIGHLY STABLE COMPLEXES PROLINX, INC. (US) 1998-02-12 WO disclosed
WO-1998005629-A1 BORONIC COMPOUND COMPLEXING REAGENTS AND COMPLEXES PROLINX, INC. (US) 1998-02-12 WO disclosed