SCHEMBL21166980

SCHEMBL21166980

Cc1cc(C)c2c(=O)c3cc4c(cc3n(C)c2c1)c(=O)c1c(C)cc(C)cc1n4C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.35
KDM4E B2RXH2 3/20 0.33
NQO2 P16083 2/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
KDM1A O60341 1/20 0.33
KMT2A Q03164 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PARP1 P09874 1/20 0.32
ATAD2 Q6PL18 1/20 0.32
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
CYP19A1 P11511 2/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
C5AR1 P21730 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
SCHEMBL19710105 0.80 RAPGEF4 (0.36) DAOKDM4ENQO2MAPTKMT2A
SCHEMBL29432435 0.76 PIM1 (0.41) KDM4EALDH1A1POLBTDP1
SCHEMBL14493942 0.76 PIM1 (0.41) KDM4EALDH1A1POLBTDP1
SCHEMBL25752527 0.74 ATM (0.42) KDM4ENQO2MAPTHTTATM
SCHEMBL14493948 0.74 ABCB1 (0.38)
SCHEMBL14493946 0.74 ABCB1 (0.38)
SCHEMBL25752526 0.73 ATM (0.50) KDM4EMAPTHTTATMKMT2A
SCHEMBL21167129 0.72
SCHEMBL13412890 0.69 KDM4E (0.49) KDM4EMAPTHTTATMKMT2A
SCHEMBL7644324 0.68 KDM4E (0.37) DAOKDM4EMAPTHTTKMT2A

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-20190221745-A1 PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, OPTICAL SENSOR, AND COMPOUND FUJIFILM CORPORATION (JP) 2019-07-18 US disclosed