SCHEMBL8060281

SCHEMBL8060281

CCCCCC(CC)(CC)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HTR7 P34969 1/20 0.35
HTR2B P41595 1/20 0.35
SIGMAR1 Q99720 2/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
PGR P06401 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31

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
SCHEMBL29111158 0.82 PNMT (0.40) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL3786405 0.80 PNMT (0.38) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL1448599 0.79 PNMT (0.42) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL704466 0.77 PNMT (0.36) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL7111117 0.75 PNMT (0.46) PNMTNPC1RAB9AHTR7HTR2B
Hexane SCHEMBL8201767 0.73 PNMT (0.47) PNMTNPC1RAB9AHTR7HTR2B
Hexane SCHEMBL8572947 0.73 PNMT (0.47) PNMTNPC1RAB9AHTR7HTR2B
Fluorene SCHEMBL25291666 0.73 MAOA (0.50) PNMTNPC1RAB9AHTR2BSIGMAR1
SCHEMBL2687014 0.72 PNMT (0.44) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL29111154 0.72 PNMT (0.36) PNMTNPC1RAB9AHTR7HTR2B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1011154-A1 Polyimide layer comprising functional material, device employing the same and method of manufacturing same device Sony International (Europe) GmbH (DE) 2000-06-21 EP disclosed