SCHEMBL1028658

SCHEMBL1028658

CC(=O)NCCNC(=O)Oc1nc(Cl)c2ccccc2c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 5/20 0.46
FTO Q9C0B1 4/20 0.46
BBOX1 O75936 3/20 0.46
CA12 O43570 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
ALDH1A1 P00352 4/20 0.41
CYP1A2 P05177 3/20 0.41
CYP2D6 P10635 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 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
SCHEMBL1033035 0.88 EGLN1 (0.47) EGLN1FTOBBOX1ALDH1A1KDM4E
SCHEMBL1028622 0.88 EGLN1 (0.47) EGLN1FTOBBOX1ALDH1A1KDM4E
SCHEMBL1033539 0.87 EGLN1 (0.46) EGLN1FTOBBOX1CYP1A2TSHR
SCHEMBL1032271 0.86 FTO (0.43) EGLN1FTOBBOX1
SCHEMBL4081511 0.81 EGLN1 (0.49) EGLN1FTOBBOX1ALDH1A1KDM4E
SCHEMBL522620 0.79 EGLN1 (0.69) EGLN1FTOBBOX1
SCHEMBL1033387 0.77 FTO (0.46) EGLN1FTOBBOX1KDM4ETP53
SCHEMBL4073465 0.76 EGLN1 (0.49) EGLN1FTOBBOX1ALDH1A1KDM4E
SCHEMBL4070933 0.74 SMN1; SMN2 (0.43) EGLN1HPGDHSD17B10MTNR1AMTNR1B
SCHEMBL4074699 0.74 SMN1; SMN2 (0.43) EGLN1MTNR1AMTNR1B

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-1644336-B1 NITROGEN-CONTAINING HETEROARYL COMPOUNDS AND THEIR USE IN INCREASING ENDOGENEOUS ERYTHROPOIETIN FIBROGEN INC (US) 2011-01-19 EP claimed