SCHEMBL26472677

SCHEMBL26472677

N#Cc1ccc(-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 10/20 0.35
▸ ABCB1 P08183 5/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CYP1A2 P05177 3/20 0.34
▸ CYP3A4 P08684 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ CLK4 Q9HAZ1 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ ABCC1 P33527 2/20 0.32
▸ PDPK1 O15530 1/20 0.32
▸ MAPK1 P28482 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
SCHEMBL26472750 0.97 ABCG2 (0.34) ABCG2ABCB1CYP1A2CYP3A4MEN1
SCHEMBL21364733 0.96 ABCG2 (0.34) ABCG2ABCB1CYP1A2CYP3A4MEN1
SCHEMBL21364553 0.93 ABCG2 (0.34) ABCG2ABCB1CYP1A2CYP3A4MEN1
SCHEMBL26473296 0.93 CYP1A2 (0.41) ABCG2KDM4ECYP1A2CYP3A4MEN1
SCHEMBL22137211 0.93 ABCG2 (0.35) ABCG2ABCB1KDM4EATML3MBTL1
SCHEMBL26472749 0.92 ABCG2 (0.37) ABCG2ABCB1KDM4EATML3MBTL1
SCHEMBL23127800 0.92 L3MBTL1 (0.40) ABCG2KDM4EATML3MBTL1MEN1
SCHEMBL22242959 0.92 CYP1A2 (0.35) ABCG2ABCB1KDM4EATML3MBTL1
SCHEMBL21364599 0.91 ABCG2 (0.32) ABCG2ABCB1KDM4EATML3MBTL1
SCHEMBL26480568 0.91 ABCG2 (0.38) ABCG2ABCB1KDM4EATML3MBTL1

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-20230127360-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2023-04-27 — — US disclosed
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