SCHEMBL366340

SCHEMBL366340

CCOC(=O)c1c2ccccc2n2cc(OCc3cccc(Cl)c3)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.49
MAOA P21397 2/20 0.47
PTGES O14684 2/20 0.47
ALOX5 P09917 4/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 2/20 0.47
CYP1A2 P05177 1/20 0.47
GAA P10253 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 2/20 0.46
SLC26A4 O43511 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46
KDM4E B2RXH2 1/20 0.46
APAF1 O14727 1/20 0.46
ALDH1A1 P00352 1/20 0.46
G6PD P11413 1/20 0.46

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
SCHEMBL364182 0.91 MAOB (0.46) MAOBKMT2AMAPTGAASMN1; SMN2
SCHEMBL364482 0.90 KDM4E (0.48) PTGESKMT2AMAPTGAASMN1; SMN2
SCHEMBL366971 0.90 MAPT (0.48) KMT2AMAPTGAASMN1; SMN2MEN1
SCHEMBL366360 0.87 FFAR1 (0.47) MAOBMAOAKMT2AMAPTGAA
SCHEMBL366974 0.87 MAOB (0.49) MAOBKMT2AMAPTMEN1KDM4E
SCHEMBL365497 0.86 MAOB (0.50) MAOBMAOAKMT2AMAPTMEN1
SCHEMBL366702 0.86 MAOB (0.48) MAOBKMT2AMAPTGAAMEN1
SCHEMBL364702 0.86 KDM4E (0.45) ALOX5KMT2AMAPTCYP1A2GAA
SCHEMBL364784 0.85 KDM4E (0.47) MAOBKMT2AMAPTGAASMN1; SMN2
SCHEMBL366339 0.85 KMT2A (0.64) MAOBMAOAALOX5KMT2AMAPT

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
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed