SCHEMBL6060435

SCHEMBL6060435

O=C(O)c1nc(O)c2ccccc2c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RNASEH1 O60930 3/20 0.45
ERCC1 P07992 1/20 0.45
FEN1 P39748 1/20 0.45
ERCC4 Q92889 1/20 0.45
HPGD P15428 3/20 0.44
HSD17B10 Q99714 3/20 0.44
LDHA P00338 1/20 0.44
THRB P10828 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
ATIC P31939 1/20 0.44
BBOX1 O75936 3/20 0.44
EGLN1 Q9GZT9 3/20 0.44
FTO Q9C0B1 2/20 0.44
DHODH Q02127 2/20 0.42
PDE10A Q9Y233 1/20 0.42

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
SCHEMBL522787 0.81 EGLN1 (0.65) ALDH1A1MAPTSMN1; SMN2RNASEH1ERCC1
SCHEMBL523579 0.81 RNASEH1 (0.46) ALDH1A1MAPTSMN1; SMN2RNASEH1ERCC1
SCHEMBL10389582 0.79 DHODH (0.54) ALDH1A1MAPTSMN1; SMN2RNASEH1ERCC1
SCHEMBL14586393 0.78 ERCC1 (0.49) ALDH1A1MAPTRNASEH1ERCC1FEN1
SCHEMBL6061140 0.78 EGLN1 (0.54) THRBBBOX1EGLN1FTO
SCHEMBL12458989 0.78 EGLN2 (0.46) ALDH1A1MAPTSMN1; SMN2RNASEH1ERCC1
SCHEMBL15832853 0.78 EGLN2 (0.47) ALDH1A1MAPTSMN1; SMN2RNASEH1ERCC1
SCHEMBL6060414 0.78 EGLN1 (0.55) THRBBBOX1EGLN1FTO
SCHEMBL27673637 0.77 DHODH (0.43) ALDH1A1EGLN1DHODHMEN1KMT2A
SCHEMBL11375833 0.77 LDHA (0.49) ALDH1A1MAPTSMN1; SMN2HSD17B10LDHA

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-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
US-4259527-A OXIDATION OF SECONDARY ALCOHOLS TO KETONES WITH HYDROGEN PEROXIDE ALLIED CHEMICAL CORPORATION (US) 1981-03-31 US disclosed
US-4171313-A OF ALICYCLIC KETONES TO LACTONES, W-HYDROXY ACIDS AND ESTERS USING HYDROGEN PEROXIDE AS AN OXIDIZING AGENT ALLIED CHEMICAL CORPORATION (US) 1979-10-16 US disclosed