SCHEMBL22706366

SCHEMBL22706366

CCc1nc2ccccc2n1-c1cccc2c(-c3ccc4c5ccccc5n5c6ccccc6c3c45)c3cccc(-n4c(CC)nc5ccccc54)c3cc12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.35
GSR P00390 2/20 0.34
PIK3R2 O00459 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDE10A Q9Y233 1/20 0.33
TSHR P16473 2/20 0.33
GAA P10253 1/20 0.33
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
BMI1 P35226 1/20 0.32
RECQL P46063 1/20 0.32
MAPK1 P28482 1/20 0.32
NQO2 P16083 1/20 0.32

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
SCHEMBL22707484 0.81 ALDH1A1 (0.37) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL22707308 0.78 ALDH1A1 (0.42) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL26344175 0.76 MAPT (0.42) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL26344150 0.76 MAPT (0.42) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL26343538 0.75 KDM4E (0.44) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL22707307 0.75 ALDH1A1 (0.38) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL26344047 0.74 ALDH1A1 (0.45) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL26345611 0.73 ALDH1A1 (0.39) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL26344119 0.73 ALDH1A1 (0.42) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL24674309 0.73 ALDH1A1 (0.35) MAPTALDH1A1KDM4EMEN1HPGD

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-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed