SCHEMBL17348783

SCHEMBL17348783

Bc1ccc2c(c1)c1ncccc1n2-c1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 5/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GRM5 P41594 2/20 0.31
TOP1 P11387 2/20 0.31
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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
SCHEMBL17348787 0.93 TOP1 (0.37) KMT2ATSHRALDH1A1CYP2C19KDM4E
SCHEMBL17349627 0.86 ABCG2 (0.38) ABCG2KMT2ATSHRALDH1A1CYP2C19
SCHEMBL17348485 0.86 MEN1 (0.39) KMT2ATSHRALDH1A1KDM4EGRM5
SCHEMBL17349539 0.86 L3MBTL1 (0.44) ABCG2KMT2ATSHRALDH1A1KDM4E
SCHEMBL17349403 0.85 KDM4E (0.40) ABCG2TSHRALDH1A1CYP2C19KDM4E
SCHEMBL17349169 0.85 KDM4E (0.40) ABCG2TSHRALDH1A1CYP2C19KDM4E
SCHEMBL16304720 0.84 KDM4E (0.38) ABCG2KMT2ATSHRALDH1A1CYP2C19
SCHEMBL18958462 0.84 KDM4E (0.38) ABCG2KMT2ATSHRALDH1A1CYP2C19
SCHEMBL17349027 0.84 KDM4E (0.38) ABCG2KMT2ATSHRALDH1A1CYP2C19
SCHEMBL21430843 0.82 KDM4E (0.38) ABCG2KMT2ATSHRALDH1A1CYP2C19

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-2015190867-A2 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2015-12-17 WO disclosed