SCHEMBL22245909

SCHEMBL22245909

N#Cc1ccc(Nc2cccc3c2C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ABCG2 Q9UNQ0 12/20 0.39
▸ ABCB1 P08183 7/20 0.39
▸ MEN1 O00255 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PDK2 Q15119 2/20 0.35
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ ABCC1 P33527 2/20 0.34
▸ ACP1 P24666 1/20 0.34

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
SCHEMBL26537845 0.86 MEN1 (0.44) MAPTKDM4EALDH1A1GAAMEN1
SCHEMBL23696741 0.85 MEN1 (0.45) MAPTKDM4EALDH1A1GAAABCG2
SCHEMBL24794823 0.83 MEN1 (0.38) MAPTKDM4EALDH1A1GAAMEN1
SCHEMBL25740815 0.83 ABCG2 (0.39) MAPTKDM4EALDH1A1GAAABCG2
SCHEMBL18201425 0.82 ABCG2 (0.42) MAPTKDM4EALDH1A1GAAABCG2
SCHEMBL21665667 0.81 KDM4E (0.41) MAPTKDM4EALDH1A1GAAABCG2
SCHEMBL8928411 0.80 PDK2 (0.46) MAPTKDM4EALDH1A1GAAABCG2
SCHEMBL28070737 0.79 PDK2 (0.44) MAPTKDM4EMEN1KMT2APDK2
SCHEMBL21742730 0.78 MEN1 (0.48) MAPTKDM4EALDH1A1GAAMEN1
SCHEMBL29797986 0.78 MEN1 (0.48) MAPTKDM4EALDH1A1GAAMEN1

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-2020149711-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2020-07-23 — — WO disclosed
Send feedback