SCHEMBL8248486

SCHEMBL8248486

CC(C)Cn1c(=O)c(C(=O)NCC(=O)O)c(O)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.71
HTT P42858 5/20 0.67
LMNA P02545 4/20 0.67
ALDH1A1 P00352 3/20 0.67
TSHR P16473 3/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
USP2 O75604 2/20 0.67
NPSR1 Q6W5P4 1/20 0.67
ALOX15 P16050 2/20 0.65
HSP90AA1 P07900 1/20 0.65
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
KDM4E B2RXH2 5/20 0.61
GAA P10253 1/20 0.61
L3MBTL1 Q9Y468 3/20 0.57
MAPK1 P28482 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TDP1 Q9NUW8 1/20 0.55
POLB P06746 1/20 0.55

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
SCHEMBL8244097 0.89 EGLN1 (0.69) EGLN1HTTLMNAALDH1A1SMN1; SMN2
SCHEMBL2382364 0.88 EGLN1 (0.78) EGLN1HTTLMNAALDH1A1TSHR
SCHEMBL24054898 0.86 HTT (0.62) EGLN1HTTLMNAALDH1A1TSHR
SCHEMBL10674540 0.85 HSP90AA1 (0.83) HTTLMNAALDH1A1TSHRSMN1; SMN2
SCHEMBL29280468 0.84 HSP90AA1 (0.64) HTTLMNAALDH1A1TSHRSMN1; SMN2
SCHEMBL5308937 0.83 HTT (0.64) EGLN1HTTLMNAALDH1A1TSHR
SCHEMBL8244419 0.83 EGLN1 (1.00) EGLN1HTTLMNAALOX15MEN1
SCHEMBL15846934 0.83 EGLN1 (0.70) EGLN1HTTLMNATSHRSMN1; SMN2
SCHEMBL2399702 0.82 MEN1 (0.77) EGLN1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL5333740 0.81 EGLN1 (0.61) EGLN1HTTLMNAALDH1A1TSHR

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
WO-2007038571-A2 PROLYL HYDROXYLASE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-05 WO disclosed