SCHEMBL8530924

SCHEMBL8530924

[c]1c(-c2ccccc2)cc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.37
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
ALOX5 P09917 1/20 0.32
PDE4B Q07343 2/20 0.32
PDE4A P27815 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
HDAC4 P56524 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ALDH1A1 P00352 4/20 0.31
HSD17B10 Q99714 2/20 0.31
HPGD P15428 1/20 0.31
BCL2L1 Q07817 1/20 0.31
CYP2A6 P11509 1/20 0.31
MAPK1 P28482 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
SCHEMBL7463362 0.79
SCHEMBL3846385 0.74
SCHEMBL3845011 0.74 ADORA1 (0.35) BACE1LMNAMAPTHTTALDH1A1
SCHEMBL10324889 0.72 BACE1 (0.36) BACE1LMNAMAPTHTTALOX5
SCHEMBL619469 0.71 MAPT (0.43) LMNAMAPTHTTPDE4BPDE4A
SCHEMBL10324467 0.69 BACE1 (0.46) BACE1LMNAMAPTHTTALOX5
SCHEMBL23087114 0.68 KDR (0.39) LMNAMAPTALDH1A1HPGD
SCHEMBL1035955 0.68 ALDH1A1 (0.40) LMNAMAPTALOX5ALDH1A1HSD17B10
SCHEMBL1225414 0.68 BACE1 (0.50) BACE1LMNAMAPTHTTALOX5
SCHEMBL6322478 0.67 HTT (0.46) BACE1LMNAMAPTHTTALOX5

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-20120184693-A1 ETHYLENE POLYMER PREPARATION METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-19 US disclosed
US-5756746-A KETOPYRROLES AND QUINACRIDONES FOR LIGHT STABLE AND WEATHER RESISTANT COLOR COMPOSITIONS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-05-26 US disclosed