SCHEMBL4413591

SCHEMBL4413591

O=C(O)CNC(=O)c1nc(Br)c2ccc(Cl)c(I)c2c1O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 19/20 0.52
THRA P10827 2/20 0.52
THRB P10828 2/20 0.52
FTO Q9C0B1 3/20 0.51
BBOX1 O75936 1/20 0.51
EGLN2 Q96KS0 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40

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
SCHEMBL4414166 0.84 EGLN1 (0.50) EGLN1THRATHRBFTOBBOX1
SCHEMBL4407707 0.83 EGLN1 (0.54) EGLN1THRATHRBFTOBBOX1
SCHEMBL4755239 0.81 EGLN1 (0.58) EGLN1THRATHRBFTOBBOX1
SCHEMBL4418148 0.81 EGLN1 (0.52) EGLN1THRATHRBFTOBBOX1
SCHEMBL3924454 0.81 EGLN1 (0.65) EGLN1THRATHRBFTOBBOX1
SCHEMBL4411746 0.80 EGLN1 (0.61) EGLN1THRATHRBFTOBBOX1
SCHEMBL4408921 0.79 EGLN1 (0.49) EGLN1THRATHRBFTOBBOX1
SCHEMBL5318572 0.79 EGLN1 (0.50) EGLN1THRATHRBFTOBBOX1
SCHEMBL523120 0.77 EGLN1 (0.67) EGLN1THRATHRBFTOBBOX1
SCHEMBL522338 0.77 EGLN1 (0.60) EGLN1THRATHRBFTOBBOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008040002-A9 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR HIF MODULATING COMPOUNDS HUTCHINSON FRED CANCER RES (US) 2009-04-16 WO disclosed
WO-2009002533-A1 INFLAMMATORY BOWEL DISEASE THERAPIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2008-12-31 WO disclosed
WO-2008040002-A2 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR HIF MODULATING COMPOUNDS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2008-04-03 WO disclosed
WO-2007047194-A2 METHODS FOR TREATING MITF-RELATED DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2007-04-26 WO disclosed