SCHEMBL4883610

SCHEMBL4883610

NCC(=O)OC(=O)c1c(O)nc(-c2ccccc2)n(-c2ccccc2)c1=O

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.62
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 3/20 0.41
HSP90AA1 P07900 1/20 0.40
MAPT P10636 1/20 0.40
RECQL P46063 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALDH1A1 P00352 7/20 0.38
AKT1 P31749 2/20 0.37
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL4740494 0.74 HTT (0.65) HTTMEN1KMT2AGAAALDH1A1
SCHEMBL13800066 0.70 HTT (0.59) HTTMEN1KMT2AGAAHSP90AA1
SCHEMBL14571460 0.65 KMT2A (0.80) HTTMEN1KMT2AGAAHSP90AA1
SCHEMBL17643209 0.62 MEN1 (0.80) HTTMEN1KMT2AGAAHSP90AA1
SCHEMBL186246 0.62 LMNA (0.52) MEN1KMT2AGAAMAPTRECQL
SCHEMBL3663307 0.62 ABL1 (0.43) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL2681081 0.62 GABRA2 (0.58) KMT2AGAAMAPTCYP2C19KDM4E
SCHEMBL27031267 0.62 KDM4E (0.48) HTTMEN1KMT2ARECQLKDM4E
SCHEMBL17643227 0.61 MEN1 (0.83) HTTMEN1KMT2AGAAHSP90AA1
SCHEMBL4742652 0.61 APLNR (0.54) HTTMEN1KMT2AGAAHSP90AA1

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-2008089051-A1 N-SUBSTITUTED GLYCINE DERIVATIVES: PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-07-24 WO disclosed