SCHEMBL15547489

SCHEMBL15547489

COC(=O)c1ncc2ccc(Oc3ccc(OC)cc3)cc2c1CO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 6/20 0.46
EGLN1 Q9GZT9 6/20 0.46
MTNR1A P48039 3/20 0.41
MTNR1B P49286 3/20 0.41
GABRA1 P14867 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
THRA P10827 2/20 0.39
THRB P10828 2/20 0.39
PTGS2 P35354 1/20 0.39
PLA2G2A P14555 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRB2 P47870 1/20 0.39
GABRA4 P48169 1/20 0.39
GABRE P78334 1/20 0.39

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
SCHEMBL15549349 0.92 EGLN2 (0.53) EGLN2EGLN1THRATHRB
SCHEMBL15548046 0.91 EGLN2 (0.53) EGLN2EGLN1THRATHRB
SCHEMBL6060882 0.87 MTNR1A (0.43) EGLN2EGLN1MTNR1AMTNR1BGABRA1
SCHEMBL15547324 0.85 EGLN1 (0.59) EGLN2EGLN1THRATHRB
SCHEMBL16844175 0.84 EGLN2 (0.55) EGLN2EGLN1THRATHRB
SCHEMBL15268696 0.82 EGLN1 (0.55) EGLN2EGLN1THRATHRB
SCHEMBL6060086 0.78 EGLN2 (0.48) EGLN2EGLN1GABRA1GABRG2GABRB3
SCHEMBL6060451 0.77 GABRA1 (0.41) EGLN2MTNR1AMTNR1BGABRA1GABRG2
SCHEMBL2015417 0.77 HIF1A (0.43) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL15268444 0.77 EGLN2 (0.65) EGLN2EGLN1

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