SCHEMBL9890599

SCHEMBL9890599

Cn1c2ccccc2c2c3c4cc(-n5c6ccccc6c6ccccc65)ccc4n(-c4ccc5oc6ccccc6c5c4)c3ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.40
KDM4E B2RXH2 5/20 0.37
MAPT P10636 5/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HTT P42858 2/20 0.37
HSD17B10 Q99714 1/20 0.37
NQO2 P16083 1/20 0.36
CHRNA7 P36544 1/20 0.36
KCNH2 Q12809 1/20 0.36
ATM Q13315 1/20 0.35
AHR P35869 1/20 0.34
PABPC1 P11940 1/20 0.34
KIF11 P52732 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
SCHEMBL18416383 0.97 KDM4E (0.39) GPR3KDM4EMAPTMEN1ALDH1A1
SCHEMBL9892678 0.92 KDM4E (0.42) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL18416363 0.90 AHR (0.39) GPR3KDM4EMAPTMEN1ALDH1A1
SCHEMBL9889813 0.90 KDM4E (0.44) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL9889811 0.89 MAPT (0.45) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL19696349 0.89 MAPT (0.35) GPR3KDM4EMAPTMEN1ALDH1A1
SCHEMBL9890605 0.87 KDM4E (0.50) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL9889817 0.87 KDM4E (0.42) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL17246135 0.87 MAPT (0.42) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL18415792 0.86 GPR3 (0.43) GPR3KDM4EMAPTMEN1ALDH1A1

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-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed