SCHEMBL6060086

SCHEMBL6060086

CCCCOC(=O)c1ncc2cc(Oc3ccc(OC)cc3)ccc2c1CO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 10/20 0.48
EGLN1 Q9GZT9 9/20 0.48
GABRA1 P14867 4/20 0.40
GABRG2 P18507 4/20 0.40
GABRB3 P28472 4/20 0.40
GABRA5 P31644 4/20 0.40
GABRA3 P34903 4/20 0.40
GABRA2 P47869 4/20 0.40
PTGS2 P35354 1/20 0.40
GABRP O00591 2/20 0.39
GABRD O14764 2/20 0.39
GABRB1 P18505 2/20 0.39
GABRB2 P47870 2/20 0.39
GABRA4 P48169 2/20 0.39
GABRE P78334 2/20 0.39
GABRA6 Q16445 2/20 0.39
GABRG1 Q8N1C3 2/20 0.39
GABRG3 Q99928 2/20 0.39
GABRQ Q9UN88 2/20 0.39
SLC2A1 P11166 1/20 0.38

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
SCHEMBL6060882 0.92 MTNR1A (0.43) EGLN2EGLN1GABRA1GABRG2GABRB3
SCHEMBL6060051 0.92 EGLN1 (0.48) EGLN2EGLN1
SCHEMBL6060534 0.91 POLB (0.40) EGLN2EGLN1GABRA1GABRG2GABRB3
SCHEMBL6059991 0.91 PPARG (0.40) EGLN2EGLN1GABRA1GABRG2GABRB3
SCHEMBL6060515 0.88 ALOX5 (0.39) EGLN2EGLN1GABRA1GABRG2GABRB3
SCHEMBL1034312 0.88 GABRA1 (0.38) EGLN2EGLN1GABRA1GABRG2GABRB3
SCHEMBL522048 0.87 EGLN2 (0.59) EGLN2EGLN1
SCHEMBL15548046 0.87 EGLN2 (0.53) EGLN2EGLN1
SCHEMBL6060451 0.82 GABRA1 (0.41) EGLN2GABRA1GABRG2GABRB3GABRA5
SCHEMBL22493050 0.82 EGLN1 (0.51) EGLN2EGLN1GABRA1GABRG2GABRB3

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-1644336-A1 NITROGEN-CONTAINING HETEROARYL COMPOUNDS AND THEIR USE IN INCREASING ENDOGENEOUS ERYTHROPOIETIN FIBROGEN, INC. (US) 2006-04-12 EP disclosed
WO-2004108681-A1 NITROGEN-CONTAINING HETEROARYL COMPOUNDS AND THEIR USE IN INCREASING ENDOGENOUS ERYTHROPOIETIN FIBROGEN, INC. (US) 2004-12-16 WO disclosed