SCHEMBL11214271

SCHEMBL11214271

CCOC(=O)C(C)c1cc(N)c(O)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.38
MAPT P10636 1/20 0.38
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
ALDH1A1 P00352 3/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 3/20 0.36
ALOX15 P16050 2/20 0.36
MEN1 O00255 2/20 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
SCHEMBL11214616 0.85 MT-CO2 (0.40) CA1CA2CA12CA9PSEN1
SCHEMBL11212265 0.81 CA12 (0.40) PKMMAPTCA1CA2CA12
SCHEMBL9743420 0.81 PSEN1 (0.45) CA1CA2CA12CA9PSEN1
Hydrochloric Acid SCHEMBL11262474 0.79 SLC6A2 (0.44) CA1CA2CA12CA9PSEN1
SCHEMBL11220273 0.77 GABRA1 (0.40) PKMCA1CA2CA12CA9
SCHEMBL491002 0.76 CYP3A4 (0.43) CA1CA2CA12CA9ESR1
SCHEMBL2131626 0.76 LMNA (0.42) MAPTCA1CA2CA12CA9
SCHEMBL5633456 0.76 PSEN1 (0.46) CA1CA2CA12CA9PSEN1
SCHEMBL4136277 0.76 ALDH1A1 (0.57) PKMMAPTCA1CA2CA12
SCHEMBL4128444 0.75 PSEN1 (0.42) PKMMAPTPSEN1PSEN2APH1B

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
EP-0081321-A1 2-Aminophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1983-06-15 EP disclosed