SCHEMBL3406591

SCHEMBL3406591

CC(C)Oc1ccc2c(O)c(C(=O)O)nc(Cl)c2c1.CN(C)CC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 8/20 0.44
THRA P10827 5/20 0.44
THRB P10828 5/20 0.44
PRKAB2 O43741 1/20 0.37
PRKAG1 P54619 1/20 0.37
PRKAA2 P54646 1/20 0.37
PRKAA1 Q13131 1/20 0.37
PRKAG3 Q9UGI9 1/20 0.37
PRKAG2 Q9UGJ0 1/20 0.37
PRKAB1 Q9Y478 1/20 0.37
BBOX1 O75936 4/20 0.37
FTO Q9C0B1 3/20 0.37
ALDH1A1 P00352 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A3 Q01959 1/20 0.35
ASPH Q12797 1/20 0.35
KDM8 Q8N371 1/20 0.35
MCL1 Q07820 2/20 0.35
BCL2L1 Q07817 1/20 0.35
KMT2A Q03164 1/20 0.34

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
SCHEMBL523239 0.88 EGLN1 (0.50) EGLN1THRATHRBPRKAB2PRKAG1
SCHEMBL522422 0.83 EGLN1 (0.45) EGLN1THRATHRBPRKAB2PRKAG1
SCHEMBL28095852 0.81 EGLN1 (0.52) EGLN1THRATHRBBBOX1FTO
SCHEMBL522261 0.81 EGLN1 (0.47) EGLN1THRATHRBBBOX1FTO
SCHEMBL522160 0.80 EGLN1 (0.43) EGLN1THRATHRBPRKAB2PRKAG1
SCHEMBL523053 0.78 EGLN1 (0.43) EGLN1THRATHRBBBOX1FTO
SCHEMBL521928 0.77 EGLN1 (0.53) EGLN1THRATHRBBBOX1FTO
SCHEMBL523849 0.77 EGLN1 (0.43) EGLN1THRATHRBBBOX1FTO
SCHEMBL522268 0.76 THRA (0.72) EGLN1THRATHRBBBOX1FTO
SCHEMBL5143765 0.76 EGLN1 (0.44) EGLN1THRATHRBPRKAB2PRKAG1

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
EP-1919463-B1 USE OF HIF 1ALFA MODULATORS FOR TREATMENT OF CANCER FIBROGEN INC (US) 2010-06-09 EP disclosed