SCHEMBL11295447

SCHEMBL11295447

COc1cc2c(cc1OC)C(C)(C)/C(=N/O)C2=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
MALT1 Q9UDY8 1/20 0.35
TNFSF11 O14788 1/20 0.34
ALK Q9UM73 2/20 0.34
KDM4E B2RXH2 3/20 0.33
LCK P06239 2/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
USP8 P40818 1/20 0.32
USP7 Q93009 1/20 0.32
ACHE P22303 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL11295450 1.00 CA1 (0.43) CA1CA2CA7CA9MALT1
SCHEMBL12512832 0.78 ALDH1A1 (0.46) CA1CA2CA7CA9KDM4E
SCHEMBL11293009 0.78 ALDH1A1 (0.46) CA1CA2CA7CA9MALT1
SCHEMBL11292464 0.78 ALDH1A1 (0.46) CA1CA2CA7CA9MALT1
SCHEMBL18948937 0.75 CA1 (0.43) CA1CA2CA7CA9MALT1
SCHEMBL21098267 0.72 CA1 (0.41) CA1CA2CA7CA9MALT1
SCHEMBL11292642 0.72 PDK2 (0.44) CA1CA2CA7CA9KDM4E
SCHEMBL8829493 0.69 PGR (0.40) KDM4EMAPTCYP3A4ALDH1A1MEN1
SCHEMBL11305762 0.69 PDK2 (0.45) CA1CA7CA9ALKMAPT
SCHEMBL11305757 0.69 PDK2 (0.45) CA1CA7CA9ALKMAPT

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-0005821-B1 INDANAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Hokuriku Pharmaceutical Co.,Ltd (JP) 1982-12-08 EP disclosed
EP-0005821-A1 Indanamine derivatives, process for their preparation and medicaments containing them Hokuriku Pharmaceutical Co.,Ltd (JP) 1979-12-12 EP disclosed