SCHEMBL6988711

SCHEMBL6988711

COc1ccc(N(C(=O)c2cc(C(=O)O)ccn2)c2ccc(OC)c(OC)c2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA7 P43166 1/20 0.51
TPMT P51580 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
FTO Q9C0B1 4/20 0.49
KDM4C Q9H3R0 3/20 0.49
KDM4E B2RXH2 3/20 0.49
ALKBH5 Q6P6C2 3/20 0.49
KDM6B O15054 2/20 0.49
KDM5C P41229 2/20 0.49
KDM2A Q9Y2K7 2/20 0.49
KDM3A Q9Y4C1 2/20 0.49
ALDH1A1 P00352 2/20 0.49
TET3 O43151 1/20 0.49
KDM4A O75164 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
SCHEMBL6988718 0.92 RAB9A (0.41) CA12CA1CA2CA4CA6
SCHEMBL6993029 0.77 ALDH1A1 (0.48) CA12CA1CA2CA4CA6
SCHEMBL6986935 0.77 KDM5A (0.49) FTOKDM4CKDM4EALKBH5KDM6B
SCHEMBL2932540 0.75 CYP1A1 (0.48) CA12CA1CA2CA4CA6
SCHEMBL2931194 0.73 PDE4A (0.56)
SCHEMBL17819893 0.73 FTO (0.67) FTOKDM4CKDM4EALKBH5KDM6B
SCHEMBL6071187 0.73 PDE4B (0.46)
SCHEMBL15129879 0.71 KDM4C (0.61) CA12CA1CA2CA4CA6
SCHEMBL6989808 0.71 KDM4C (0.48) CA1CA2FTOKDM4CKDM4E
Veratric Acid SCHEMBL976032 0.70 CA12 (1.00) CA12CA1CA2CA4CA6

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