SCHEMBL15547656

SCHEMBL15547656

COc1ccc(Oc2ccc3c(CO)c(C(=O)NCC(=O)O)ncc3c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 11/20 0.64
EGLN2 Q96KS0 4/20 0.60
THRA P10827 10/20 0.56
THRB P10828 10/20 0.56
BBOX1 O75936 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
ASPH Q12797 1/20 0.50
KDM8 Q8N371 1/20 0.50
FTO Q9C0B1 1/20 0.50

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
SCHEMBL15547324 0.92 EGLN1 (0.59) EGLN1EGLN2THRATHRBBBOX1
SCHEMBL1115849 0.92 EGLN1 (0.77) EGLN1EGLN2THRATHRBBBOX1
Water SCHEMBL15548472 0.91 EGLN1 (0.75) EGLN1EGLN2THRATHRBBBOX1
SCHEMBL15549510 0.91 EGLN1 (0.75) EGLN1EGLN2THRATHRBBBOX1
SCHEMBL15549041 0.91 EGLN1 (0.75) EGLN1EGLN2THRATHRBBBOX1
SCHEMBL522758 0.87 EGLN1 (0.84) EGLN1EGLN2THRATHRB
SCHEMBL3915087 0.87 EGLN1 (0.61) EGLN1EGLN2THRATHRB
SCHEMBL15547171 0.87 EGLN1 (0.60) EGLN1EGLN2THRATHRB
SCHEMBL15548046 0.85 EGLN2 (0.53) EGLN1EGLN2THRATHRB
SCHEMBL1115578 0.83 EGLN1 (0.67) EGLN1EGLN2THRATHRBBBOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872487-A1 PROCESS FOR MAKING ISOQUINOLINE COMPOUNDS Fibrogen, Inc. (US) 2015-05-20 EP disclosed
WO-2014014834-A1 PROCESS FOR MAKING ISOQUINOLINE COMPOUNDS FIBROGEN, INC. (US) 2014-01-23 WO disclosed