SCHEMBL14829907

SCHEMBL14829907

CCOC(=O)c1c(O)c(=O)[nH]c2cc(Cc3ccccc3)ccc12

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.53
GABRB1 P18505 1/20 0.53
GABRA3 P34903 1/20 0.53
GABRB2 P47870 1/20 0.53
ALOX15 P16050 2/20 0.48
KDM5A P29375 1/20 0.48
KDM5B Q9UGL1 1/20 0.48
ALOX5 P09917 3/20 0.48
CSF1R P07333 1/20 0.47
PDE3B Q13370 1/20 0.47
PDE3A Q14432 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
SCHEMBL5309082 0.92 KDM5A (0.58) GABRA1GABRB1GABRA3GABRB2KDM5A
SCHEMBL14830067 0.84 CSF1R (0.54) KDM5AKDM5BALOX5CSF1R
SCHEMBL18584559 0.82 KDM5A (0.57) ALOX15KDM5AKDM5BALOX5
SCHEMBL14830064 0.82 KDM5A (0.52) ALOX15KDM5AKDM5B
SCHEMBL31298134 0.81 ALDH1A1 (0.59) KDM5AKDM5BALOX5
SCHEMBL14829865 0.81 ALDH1A1 (0.59) KDM5AKDM5BALOX5
SCHEMBL4647482 0.81 KDM5A (0.64) KDM5AKDM5B
SCHEMBL5308554 0.80 KDM5A (0.55) KDM5AKDM5BALOX5
SCHEMBL14830735 0.80 ALOX15 (0.64) ALOX15CSF1R
SCHEMBL14829933 0.78 KDM5A (0.48) ALOX15KDM5AKDM5BALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760840-A1 QUINOLINONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE Bristol-Myers Squibb Company (US) 2014-08-06 EP disclosed
WO-2013048942-A1 QUINOLINONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-04 WO disclosed