SCHEMBL4399883

SCHEMBL4399883

FC(F)(F)c1cccc(-c2c3ccccc3c(-c3ccc(-c4ccccc4)cc3)c3ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.53
CNR2 P34972 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
ESR1 P03372 1/20 0.48
MAOB P27338 1/20 0.47
KDM1A O60341 1/20 0.46
PTPN1 P18031 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDO2 P48775 1/20 0.46
SCN2A Q99250 1/20 0.45
TSHR P16473 1/20 0.45
PTPN5 P54829 1/20 0.45
ADORA1 P30542 2/20 0.44
IKBKB O14920 1/20 0.44
ADORA2A P29274 1/20 0.44
BRD4 O60885 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL22978405 0.96 CNR2 (0.53) KIF11CNR2TDP1ESR1ALDH1A1
SCHEMBL14521847 0.89 CNR2 (0.50) KIF11CNR2TDP1ESR1ALDH1A1
SCHEMBL4400718 0.88 KIF11 (0.62) KIF11ESR1PTPN1ALDH1A1TSHR
SCHEMBL13828143 0.88 CNR2 (0.44) KIF11CNR2TDP1ESR1MAOB
SCHEMBL14521846 0.85 TDP1 (0.52) KIF11CNR2TDP1ESR1MAOB
SCHEMBL13499824 0.85 KIF11 (0.46) KIF11CNR2TDP1MAOBKDM1A
SCHEMBL21223724 0.85 CYP1A2 (0.48) CNR2TDP1ESR1MAOBADORA1
SCHEMBL26821704 0.85 KIF11 (0.67) KIF11CNR2MAOBKDM1APTPN1
SCHEMBL24106776 0.85 KIF11 (0.67) KIF11CNR2MAOBKDM1APTPN1
SCHEMBL22993296 0.84 CYP1A1 (0.45) KIF11CNR2TDP1ESR1MAOB

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-1680480-B1 OLED DEVICE WITH ASYMMETRIC HOST GLOBAL OLED TECHNOLOGY LLC (US) 2012-05-02 EP disclosed