SCHEMBL16670351

SCHEMBL16670351

Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccc(-c4ccc5c[c]ccc5c4)cc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.41
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
OPRK1 P41145 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CTRC Q99895 1/20 0.31
KIF11 P52732 1/20 0.31
SLC6A2 P23975 1/20 0.30

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
SCHEMBL20543243 0.85 MEN1 (0.36) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL29375118 0.83 PDK2 (0.55) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL29493741 0.83 PDK2 (0.55) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL16176940 0.83 PDK2 (0.55) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL16177483 0.83 PDK2 (0.55) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL29756627 0.83 PDK2 (0.55) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL29615782 0.83 PDK2 (0.55) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL16670301 0.81 PDK2 (0.47) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL18466672 0.78 PDK2 (0.43) PDK2ESR1ESR2SMN1; SMN2KDM4E
SCHEMBL2233600 0.78 MEN1 (0.47) PDK2ESR1ESR2SMN1; SMN2KDM4E

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
WO-2015061074-A1 ELECTRONIC DEVICE INCLUDING A FLUORANTHENE DERIVATIVE E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-04-30 WO disclosed