SCHEMBL8678488

SCHEMBL8678488

C(#Cc1cccc2c1Cc1ccccc1-2)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.45
NPC1 O15118 4/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
APP P05067 1/20 0.41
RAB9A P51151 3/20 0.40
KCNH2 Q12809 1/20 0.38
CA2 P00918 2/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL31441037 1.00 PNMT (0.45) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL15232909 0.87 PNMT (0.41) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL32662837 0.80 PNMT (0.42) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL2746886 0.79 PNMT (0.39) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL1033059 0.78 TRPA1 (0.50) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL30940563 0.78 TRPA1 (0.50) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL6847083 0.77 PNMT (0.42) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL739760 0.77 PNMT (0.49) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL1766127 0.77 PNMT (0.49) PNMTNPC1MAPTKDM4EALDH1A1
SCHEMBL1612050 0.77 PNMT (0.49) PNMTNPC1MAPTKDM4EALDH1A1

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
US-5705578-A Method for making and using a supported metallocene catalyst system PHILLIPS PETROLEUM COMPANY (US) 1998-01-06 US disclosed