SCHEMBL5138823

SCHEMBL5138823

N#Cc1nc(C(=O)NCC(=O)O)c(O)c2sc(-c3cccc(C(F)(F)F)c3)cc12.O=C(O)CNC(=O)c1nc(Br)c2cc(-c3cccc(C(F)(F)F)c3)sc2c1O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 17/20 0.49
EGLN2 Q96KS0 4/20 0.42
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
CTSK P43235 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
SCHEMBL967121 0.95 EGLN1 (0.54) EGLN1EGLN2CTSK
SCHEMBL966335 0.93 EGLN1 (0.46) EGLN1THRATHRB
SCHEMBL5138824 0.87 HDAC6 (0.37) EGLN1EGLN2CTSK
SCHEMBL1975510 0.77 MAPT (0.55) CTSK
SCHEMBL1656039 0.77 EGLN1 (0.55) EGLN1EGLN2
SCHEMBL968156 0.77 EGLN1 (0.48) EGLN1
SCHEMBL967769 0.73 EGLN1 (0.53) EGLN1EGLN2THRATHRB
SCHEMBL522183 0.72 EGLN1 (0.64) EGLN1THRATHRB
SCHEMBL523787 0.72 EGLN1 (0.58) EGLN1THRATHRB
SCHEMBL963733 0.71 EGLN1 (0.53) EGLN1EGLN2THRATHRB

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
EP-1919463-A2 USE OF HIF 1ALFA MODULATORS FOR TREATMENT OF CANCER FIBROGEN, INC. (US) 2008-05-14 EP disclosed
EP-1866318-A2 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2007-12-19 EP disclosed
WO-2006138511-A2 USE OF HIF 1ALFA MODULATORS FOR TREATMENT OF CANCER FIBROGEN, INC. (US) 2006-12-28 WO disclosed
WO-2006094292-A2 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2006-09-08 WO disclosed