SCHEMBL15280902

SCHEMBL15280902

c1ccc2c(c1)c1cnccc1n2-c1ccc(-c2ccc(Cc3ccc(-c4ccc(-n5c6ccccc6c6ccncc65)cc4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.46
MAOB P27338 4/20 0.46
ACHE P22303 2/20 0.46
CYP2D6 P10635 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
REN P00797 2/20 0.38
KCNH2 Q12809 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
HDAC3 O15379 1/20 0.38
CDK4 P11802 1/20 0.37
CDK6 Q00534 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
PTPN1 P18031 1/20 0.36
CYP17A1 P05093 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP19A1 P11511 1/20 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
SCHEMBL261852 0.96 KDM4E (0.43) MAOAMAOBACHEKDM4EATM
SCHEMBL262078 0.96 KDM4E (0.43) MAOAMAOBACHEKDM4EATM
SCHEMBL261889 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL261522 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL261524 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL16155098 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL262071 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL261840 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL262062 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E
SCHEMBL15280943 0.96 MAOA (0.49) MAOAMAOBACHECYP2D6KDM4E

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
US-20130252027-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND ILLUMINATING DEVICE Konica Minolta, Inc. (JP) 2013-09-26 US disclosed
US-20130252027-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND ILLUMINATING DEVICE Konica Minolta, Inc. (JP) 2013-09-26 US disclosed