SCHEMBL6986935

SCHEMBL6986935

CCOc1ccc(N(C(=O)c2cc(C(=O)O)ccn2)c2ccc(OCC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 2/20 0.49
KDM4C Q9H3R0 2/20 0.49
KDM5B Q9UGL1 2/20 0.49
KDM4E B2RXH2 2/20 0.49
KDM6B O15054 1/20 0.49
TET3 O43151 1/20 0.49
KDM4A O75164 1/20 0.49
BBOX1 O75936 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
KDM5C P41229 1/20 0.49
ASPH Q12797 1/20 0.49
KDM4D Q6B0I6 1/20 0.49
TET2 Q6N021 1/20 0.49
ALKBH5 Q6P6C2 1/20 0.49
KDM7A Q6ZMT4 1/20 0.49
KDM8 Q8N371 1/20 0.49
TET1 Q8NFU7 1/20 0.49
EGLN2 Q96KS0 1/20 0.49
FTO Q9C0B1 1/20 0.49

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
SCHEMBL6986939 0.92 KMT2A (0.48) KDM5AKDM4CKDM5BKDM4EALDH1A1
SCHEMBL6988711 0.77 CA12 (0.51) KDM5AKDM4CKDM5BKDM4EKDM6B
SCHEMBL5808530 0.75 ALDH1A1 (0.65) KDM5AKDM4CKDM5BKDM4EKDM6B
SCHEMBL6989313 0.73 SMN1; SMN2 (0.47) KDM5AKDM4CKDM5BKDM4EKDM6B
SCHEMBL17819893 0.73 FTO (0.67) KDM5AKDM4CKDM5BKDM4EKDM6B
SCHEMBL3854386 0.72 KDM5B (0.57) KDM5AKDM4CKDM5BKDM4EKDM6B
SCHEMBL1920448 0.72 FTO (0.61) KDM5AKDM4CKDM5BKDM4EKDM6B
SCHEMBL177390 0.70 PLA2G4B (0.82) ALDH1A1SMN1; SMN2PKMTP53NFKB1
SCHEMBL1992514 0.70 MAPT (0.57) KDM5AKDM4CKDM5BKDM4EKDM6B
SCHEMBL27639521 0.70 KDM4E (0.52) KDM5AKDM4CKDM5BKDM4EKDM6B

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-1362033-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP claimed
WO-2002064568-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed