SCHEMBL4419152

SCHEMBL4419152

COc1c(C(=O)NCC(=O)O)nc(Cl)c2cccc(I)c12

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 14/20 0.53
FTO Q9C0B1 2/20 0.53
BBOX1 O75936 1/20 0.53
THRA P10827 4/20 0.44
THRB P10828 4/20 0.44
KDM6B O15054 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL4755920 0.89 EGLN1 (0.51) EGLN1FTOBBOX1THRATHRB
SCHEMBL5027666 0.83 EGLN1 (0.68) EGLN1FTOBBOX1THRATHRB
SCHEMBL523005 0.83 EGLN1 (0.67) EGLN1FTOBBOX1THRATHRB
SCHEMBL4418059 0.81 EGLN1 (0.57) EGLN1FTOBBOX1THRATHRB
SCHEMBL523982 0.75 EGLN1 (0.55) EGLN1FTOBBOX1THRATHRB
SCHEMBL2537378 0.74 EGLN1 (0.68) EGLN1FTOBBOX1THRATHRB
SCHEMBL522443 0.74 EGLN1 (0.64) EGLN1FTOBBOX1THRATHRB
SCHEMBL30274402 0.74 EGLN1 (0.68) EGLN1FTOBBOX1THRATHRB
SCHEMBL4973457 0.72 EGLN1 (0.58) EGLN1FTOBBOX1THRATHRB
SCHEMBL4411746 0.71 EGLN1 (0.61) EGLN1FTOBBOX1THRATHRB

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 5 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
EP-1991269-A1 COMPOUNDS AND METHODS FOR TREATMENT OF STROKE FIBROGEN, INC. (US) 2008-11-19 EP 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-2007097929-A1 COMPOUNDS AND METHODS FOR TREATMENT OF STROKE FIBROGEN, INC. (US) 2007-08-30 WO disclosed
WO-2007047194-A2 METHODS FOR TREATING MITF-RELATED DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2007-04-26 WO disclosed