SCHEMBL9313893

SCHEMBL9313893

CN(C)C(=O)Cc1ccc(O)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.60
HPGD P15428 5/20 0.60
HSD17B10 Q99714 5/20 0.60
HIF1A Q16665 4/20 0.60
MAPT P10636 4/20 0.60
BLM P54132 4/20 0.60
LMNA P02545 3/20 0.60
POLB P06746 3/20 0.60
PMP22 Q01453 3/20 0.60
TDP1 Q9NUW8 3/20 0.60
NFKB1 P19838 2/20 0.60
THPO P40225 2/20 0.60
GAA P10253 2/20 0.60
APEX1 P27695 2/20 0.60
RGS12 O14924 1/20 0.60
TSHR P16473 1/20 0.60
GNAI1 P63096 1/20 0.60
TRPA1 O75762 2/20 0.50
PCNA P12004 1/20 0.49
YWHAG P61981 1/20 0.49

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
Hydrochloric Acid SCHEMBL28989826 0.98 KDM4E (0.58) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL24803332 0.85 PARP1 (0.44) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL24802436 0.85 ESR1 (0.55) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL5094928 0.84 GAA (0.53) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL10948201 0.81 TSHR (0.56) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL19182429 0.79 GPR35 (0.47) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL1973647 0.78 CA2 (0.56) LMNAPCNACA2BCHEACHE
SCHEMBL27907765 0.78 KDM4E (0.67) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL1070431 0.78 KDM4E (0.67) KDM4EHPGDHSD17B10HIF1AMAPT
SCHEMBL22982989 0.77 KDM4E (0.72) KDM4EHPGDHSD17B10HIF1AMAPT

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
US-5366996-A Administering hydroxamic acids ELFORD HOWARD L (US) 1994-11-22 US disclosed