SCHEMBL9113014

SCHEMBL9113014

CC1C(O)c2ccccc2C1O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
GPR3 P46089 2/20 0.33
NOTUM Q6P988 1/20 0.32
FUCA1 P04066 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL18080870 0.86 MAOA (0.37) MAOAMAOBMEN1GAAKMT2A
SCHEMBL27788665 0.83 MAOA (0.32) MAOAMAOBFUCA1
SCHEMBL8531691 0.81 MAOA (0.34) MAOAMAOBMEN1GAAKMT2A
SCHEMBL17928994 0.81 MAOA (0.34) MAOAMAOBMEN1GAAKMT2A
SCHEMBL17928996 0.81 MAOA (0.34) MAOAMAOBMEN1GAAKMT2A
SCHEMBL8103100 0.81 MAOA (0.34) MAOAMAOBMEN1GAAKMT2A
SCHEMBL8531689 0.81 MAOA (0.34) MAOAMAOBMEN1GAAKMT2A
SCHEMBL8050352 0.81 MAOA (0.34) MAOAMAOBMEN1GAAKMT2A
SCHEMBL13397737 0.79 HSP90AA1 (0.39) MEN1KMT2APOLB
SCHEMBL13417270 0.79 HSP90AA1 (0.39) MEN1KMT2APOLB

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-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed