SCHEMBL8562007

SCHEMBL8562007

COC(=O)c1ccc(N)c(OCC(N)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.51
ALDH1A1 P00352 3/20 0.51
HSD17B10 Q99714 3/20 0.51
KDM4E B2RXH2 3/20 0.51
GAA P10253 2/20 0.51
HPGD P15428 2/20 0.51
GLA P06280 1/20 0.51
CASP1 P29466 1/20 0.51
CASP7 P55210 1/20 0.51
ATM Q13315 1/20 0.51
USP2 O75604 1/20 0.48
TSHR P16473 4/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
SLC6A2 P23975 1/20 0.45
SCN1A P35498 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNH2 Q12809 1/20 0.45
HIF1A Q16665 1/20 0.45
SCN2A Q99250 1/20 0.45

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
SCHEMBL8562385 0.88 USP2 (0.58) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL21307088 0.85 MAPT (0.65) MAPTALDH1A1HSD17B10ATMTSHR
SCHEMBL223446 0.84 HSD17B10 (0.55) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL20602048 0.83 MAPT (0.53) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL8888393 0.82 MAPT (0.51) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL1345863 0.82 MAPT (0.51) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL11949139 0.82 CYP1A2 (0.57) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL8203218 0.81 MAPT (0.48) MAPTALDH1A1HSD17B10KDM4EGAA
Hydrochloric Acid SCHEMBL25376018 0.81 RAD52 (0.52) MAPTALDH1A1HSD17B10KDM4EGAA
SCHEMBL21879061 0.81 EP300 (0.56) MAPTALDH1A1HSD17B10KDM4EGAA

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
US-5719141-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-02-17 US disclosed
EP-0702004-A2 2,9-diamino- and 2-amino-8-carbamoyl-4-hydroxy-alkanoic acid amid derivatives CIBA-GEIGY AG (CH) 1996-03-20 EP disclosed