SCHEMBL10018484

SCHEMBL10018484

CCC(C)c1ccc(-c2ccc(-n3c4ccccc4c4cnccc43)cc2C)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.37
MAOA P21397 4/20 0.37
MAOB P27338 4/20 0.37
ACHE P22303 1/20 0.37
CYP2D6 P10635 1/20 0.35
MCL1 Q07820 1/20 0.35
GSK3B P49841 2/20 0.32
CDK4 P11802 1/20 0.32
CDK2 P24941 1/20 0.32
HTT P42858 1/20 0.32
NPY5R Q15761 1/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HDAC3 O15379 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
LMNA P02545 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
SCHEMBL10018489 0.95 ADH5 (0.34) RXFP1MCL1GSK3BCDK4CDK2
SCHEMBL14424740 0.87 MAOA (0.42) MAOAMAOBACHECYP2D6TOP2A
SCHEMBL12383089 0.86 RXFP1 (0.47) RXFP1MAOAMAOBACHECYP2D6
SCHEMBL10018482 0.85 HTT (0.35) MCL1HTTKMT2AMEN1ALDH1A1
SCHEMBL261829 0.83 MAOA (0.43) MAOAMAOBACHECYP2D6HTT
SCHEMBL261485 0.83 MAOA (0.43) MAOAMAOBACHECYP2D6HTT
SCHEMBL261774 0.83 MAOA (0.43) MAOAMAOBACHECYP2D6HTT
SCHEMBL10018486 0.83 MAOA (0.41) RXFP1MAOAMAOBACHECYP2D6
SCHEMBL20717612 0.82 MAOA (0.46) MAOAMAOBACHECYP2D6HDAC3
SCHEMBL10100904 0.82 MAOA (0.46) MAOAMAOBACHECYP2D6HDAC3

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-8101699-B2 Electron-transporting polymers GENERAL ELECTRIC COMPANY (US) 2012-01-24 US disclosed
US-20100137538-A1 ELECTRON-TRANSPORTING POLYMERS GENERAL ELECTRIC COMPANY (US) 2010-06-03 US disclosed