SCHEMBL9890126

SCHEMBL9890126

c1cc2c(cn1)c1cnccc1n2-c1ccc2oc3cc4c(cc3c2c1)oc1ccc(-n2c3ccncc3c3ccncc32)cc14

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 3/20 0.34
CDK6 Q00534 3/20 0.34
MAOA P21397 4/20 0.33
MAOB P27338 4/20 0.33
ACHE P22303 1/20 0.33
KCNH2 Q12809 1/20 0.30

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
SCHEMBL9890124 1.00 CDK4 (0.34) CDK4CDK6MAOAMAOBACHE
SCHEMBL9890400 0.96 CDK4 (0.33) CDK4CDK6MAOAMAOBACHE
SCHEMBL13529129 0.94 MAOA (0.33) MAOAMAOBACHE
SCHEMBL9890121 0.94 CDK4 (0.34) CDK4CDK6KCNH2
SCHEMBL9890587 0.92 CDK4 (0.34) CDK4CDK6MAOAMAOBACHE
SCHEMBL12114579 0.91 MAOA (0.34) MAOAMAOBACHEKCNH2
SCHEMBL9890132 0.90 KDM4E (0.38) CDK4CDK6MAOAMAOBACHE
SCHEMBL9890123 0.90 MAOA (0.43) MAOAMAOBACHE
SCHEMBL9890402 0.90 MAOA (0.32) MAOAMAOBACHE
SCHEMBL9890398 0.90 CDK4 (0.33) CDK4CDK6KCNH2

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-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed
US-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed