SCHEMBL17722992

SCHEMBL17722992

COc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OC)cc4)ccc2n3C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.61
MAPT P10636 2/20 0.61
KDM4E B2RXH2 2/20 0.61
ALDH1A1 P00352 2/20 0.61
HPGD P15428 2/20 0.61
MEN1 O00255 1/20 0.61
HTT P42858 1/20 0.61
KMT2A Q03164 1/20 0.61
HSD17B10 Q99714 1/20 0.61
BCHE P06276 2/20 0.53
ACHE P22303 2/20 0.53
ATM Q13315 1/20 0.48
KDR P35968 1/20 0.48
ABL1 P00519 1/20 0.47
ABCB1 P08183 1/20 0.47
BCR P11274 1/20 0.47
TSPO P30536 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL11047658 0.84 ALDH1A1 (0.81) L3MBTL1MAPTKDM4EALDH1A1HPGD
SCHEMBL9890928 0.81 L3MBTL1 (0.64) L3MBTL1MAPTKDM4EALDH1A1HPGD
SCHEMBL18056650 0.80 CASR (0.51) L3MBTL1MAPTKDM4EALDH1A1HPGD
SCHEMBL3365852 0.80 GRIK2 (0.61) MAPTKDM4EALDH1A1HPGDMEN1
SCHEMBL28654194 0.80 ACHE (0.80) BCHEACHEDYRK1A
SCHEMBL3358616 0.79 KDM4E (0.52) KDM4EHSD17B10TSPONPC1DYRK1A
SCHEMBL3857090 0.78 PTGS1 (0.56) ATM
SCHEMBL3853206 0.78 GRIK2 (0.56) L3MBTL1MAPTKDM4EALDH1A1HPGD
SCHEMBL6724023 0.78 GPR3 (0.50) L3MBTL1MAPTKDM4EALDH1A1HPGD
SCHEMBL6724002 0.78 GPR3 (0.50) L3MBTL1MAPTKDM4EALDH1A1HPGD

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-20160126478-A1 EMISSIVE COMPOUNDS FOR LIGHT EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2016-05-05 US disclosed