SCHEMBL6049156

SCHEMBL6049156

O=C=C1C=CC=C2c3ccccc3C(=O)C12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
TP53 P04637 4/20 0.40
CYP3A4 P08684 2/20 0.40
MAPK1 P28482 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
HTR2B P41595 1/20 0.40
KMT2A Q03164 6/20 0.36
RAB9A P51151 6/20 0.36
NPC1 O15118 6/20 0.36
MEN1 O00255 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MAPK10 P53779 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
PIM1 P11309 1/20 0.35
ALDH1A1 P00352 3/20 0.35
S100A4 P26447 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.33

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
SCHEMBL4638985 0.90 PIM1 (0.36) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL6688204 0.79 MAPT (0.45) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL8040477 0.76 MAPT (0.42) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL5094564 0.72 MAPT (0.39) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL7702135 0.72 PIM1 (0.39) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL3274379 0.69 MAPT (0.42) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL30426195 0.69
SCHEMBL5969253 0.68 MAPT (0.41) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL8794463 0.67 MAPT (0.40) MAPTTP53CYP3A4MAPK1LMNA
SCHEMBL1197981 0.67 MAPT (0.40) MAPTTP53CYP3A4MAPK1LMNA

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
JP-2006018267-A PHOTOCONDUCTIVE MEMBER XEROX CORP 2006-01-19 JP disclosed