SCHEMBL5454600

SCHEMBL5454600

COCc1nc(C(=O)[AsH][C@H](C)C(=O)O)c(O)c2ccc(Oc3ccccc3)cc12

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 15/20 0.49
EGLN1 Q9GZT9 14/20 0.49
THRA P10827 5/20 0.48
THRB P10828 5/20 0.48
BBOX1 O75936 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
ASPH Q12797 1/20 0.46
KDM8 Q8N371 1/20 0.46
FTO Q9C0B1 1/20 0.46

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
SCHEMBL5380536 1.00 EGLN2 (0.49) EGLN2EGLN1THRATHRBBBOX1
SCHEMBL5454614 1.00 EGLN2 (0.49) EGLN2EGLN1THRATHRBBBOX1
SCHEMBL523581 0.82 EGLN2 (0.58) EGLN2EGLN1THRATHRB
SCHEMBL522868 0.82 EGLN2 (0.58) EGLN2EGLN1THRATHRB
SCHEMBL522869 0.82 EGLN2 (0.58) EGLN2EGLN1THRATHRB
SCHEMBL13601811 0.82 THRA (0.52) EGLN2EGLN1THRATHRBBBOX1
SCHEMBL526495 0.81 EGLN2 (0.57) EGLN2EGLN1THRATHRB
SCHEMBL522066 0.78 THRA (0.77) EGLN1THRATHRBBBOX1SLC6A2
SCHEMBL523667 0.76 EGLN2 (0.54) EGLN2EGLN1THRATHRB
SCHEMBL523668 0.76 EGLN2 (0.54) EGLN2EGLN1THRATHRB

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
WO-2007047194-A2 METHODS FOR TREATING MITF-RELATED DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2007-04-26 WO disclosed