SCHEMBL28069879

SCHEMBL28069879

COc1ccc(Cn2ccc(C(=O)O)c(C(=O)O)c2=O)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 4/20 0.51
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
TP53 P04637 1/20 0.49
KDM4C Q9H3R0 1/20 0.49
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KLKB1 P03952 1/20 0.44
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PPARG P37231 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL12503112 0.89 MAPT (0.48) EGLN1HDAC3HDAC1HDAC6TP53
SCHEMBL27924971 0.87 EGLN1 (0.50) EGLN1HDAC3HDAC1HDAC6TP53
SCHEMBL12503041 0.80 MAPT (0.51) EGLN1HDAC3HDAC1HDAC6TP53
SCHEMBL28151559 0.79 EGLN1 (0.47) EGLN1HDAC3HDAC1HDAC6KDM4C
SCHEMBL8175132 0.79 LMNA (0.56) EGLN1HDAC3HDAC1HDAC6TP53
SCHEMBL27951469 0.79 MAPT (0.45) TP53KDM4CKMT2AALDH1A1TSHR
SCHEMBL30575755 0.78 PDE10A (0.52) EGLN1TP53KDM4CMEN1KMT2A
SCHEMBL28152715 0.77 MEN1 (0.46) EGLN1TP53KDM4CMEN1KMT2A
SCHEMBL14957514 0.77 ALDH1A1 (0.47) EGLN1HDAC3HDAC1HDAC6TP53
SCHEMBL8331084 0.76 LMNA (0.57) EGLN1HDAC3HDAC1HDAC6TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103608346-B As the 7-naphthyridine derivatives of hypoxia inducible factor (HIF) hydroxylase inhibitors 菲布罗根有限公司 2016-06-15 CN disclosed