SCHEMBL16352547

SCHEMBL16352547

c1ccc(-c2ncnc(-n3c4ccccc4c4c5c(c6ccccc6n5-c5ccccc5)c5nc(-c6ccccc6)n(-c6ccccc6)c5c43)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.40
▸ PI4K2B Q8TCG2 1/20 0.40
▸ PI4K2A Q9BTU6 1/20 0.40
▸ PI4KB Q9UBF8 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ESR1 P03372 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ TLR7 Q9NYK1 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ RXFP1 Q9HBX9 2/20 0.32
▸ IL1R1 P14778 1/20 0.32
▸ HTT P42858 3/20 0.32
▸ MAPT P10636 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ TNK2 Q07912 1/20 0.31

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
SCHEMBL16352505 0.95 PI4KA (0.37) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16352549 0.91 PI4KA (0.36) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16352560 0.90 PI4KA (0.36) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16352556 0.89 PI4KA (0.36) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16352564 0.88 L3MBTL1 (0.42) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL18057698 0.85 KDM4E (0.36) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16352516 0.84 MAPT (0.39) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16352537 0.84 ALDH1A1 (0.37) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL18057749 0.84 L3MBTL1 (0.43) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16352551 0.83 MAPK1 (0.36) PI4KAPI4K2BPI4K2API4KBALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9419229-B2 Compound, organic optoelectric device including the same and display device including the optoelectric device CHEIL INDUSTRIES, INC. (KR) 2016-08-16 — — US disclosed
US-9419229-B2 Compound, organic optoelectric device including the same and display device including the optoelectric device CHEIL INDUSTRIES, INC. (KR) 2016-08-16 — — US disclosed
US-20140374706-A1 COMPOUND, ORGANIC OPTOELECTRIC DEVICE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE OPTOELECTRIC DEVICE CHEIL INDUSTRIES, INC. (KR) 2014-12-25 — — US disclosed
US-20140374706-A1 COMPOUND, ORGANIC OPTOELECTRIC DEVICE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE OPTOELECTRIC DEVICE CHEIL INDUSTRIES, INC. (KR) 2014-12-25 — — US disclosed
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