SCHEMBL9017897

SCHEMBL9017897

Oc1cnccc1N=CN1CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.42
HTT P42858 3/20 0.39
TSHR P16473 2/20 0.37
LMNA P02545 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
POLB P06746 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HSD17B10 Q99714 2/20 0.37
USP2 O75604 1/20 0.37
RPS6KA3 P51812 2/20 0.36
RPS6KA2 Q15349 1/20 0.36
RPS6KA1 Q15418 1/20 0.36
MAPT P10636 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
KCNA5 P22460 2/20 0.33
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 3/20 0.33

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
SCHEMBL9017894 1.00 GAA (0.42) GAAHTTTSHRLMNANPC1
Dimethylcarbate SCHEMBL9680345 0.89 GAA (0.40) GAAHTTTSHRLMNANPC1
Dimethylcarbate SCHEMBL9680337 0.89 GAA (0.40) GAAHTTTSHRLMNANPC1
SCHEMBL9017919 0.86 POLB (0.35) HTTTSHRLMNARAB9APOLB
SCHEMBL9017912 0.86 POLB (0.35) HTTTSHRLMNARAB9APOLB
SCHEMBL9017845 0.85 HTT (0.37) GAAHTTTSHRLMNARAB9A
SCHEMBL9017861 0.85 HTT (0.37) GAAHTTTSHRLMNARAB9A
SCHEMBL9017859 0.85 HTT (0.37) GAAHTTTSHRLMNARAB9A
Hydrochloric Acid SCHEMBL9680977 0.85 POLB (0.35) HTTTSHRLMNARAB9APOLB
SCHEMBL9017848 0.85 HTT (0.37) GAAHTTTSHRLMNARAB9A

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
EP-0477903-B1 Substituted-4-amino-3-pyridinols, a process for their preparation and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1996-04-03 EP disclosed
EP-0477903-A2 Substituted-4-amino-3-pyridinols, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-04-01 EP disclosed