SCHEMBL28337114

SCHEMBL28337114

COc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)ccc1B(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
TUBB4A P04350 2/20 0.38
TUBB P07437 2/20 0.38
TUBA3C P0DPH7 2/20 0.38
TUBA1B P68363 2/20 0.38
TUBA4A P68366 2/20 0.38
TUBB4B P68371 2/20 0.38
TUBB3 Q13509 2/20 0.38
TUBB2A Q13885 2/20 0.38
TUBB8 Q3ZCM7 2/20 0.38
TUBA3E Q6PEY2 2/20 0.38
TUBA1A Q71U36 2/20 0.38
TUBA1C Q9BQE3 2/20 0.38
TUBB6 Q9BUF5 2/20 0.38
TUBB2B Q9BVA1 2/20 0.38
TUBB1 Q9H4B7 2/20 0.38
TLR9 Q9NR96 4/20 0.38

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
SCHEMBL14039032 0.79 ENPP2 (0.49) ENPP2L3MBTL1KDM4EATMTUBB4A
SCHEMBL17539930 0.78 MGLL (0.50) ENPP2L3MBTL1KDM4EATMHTR7
SCHEMBL29634603 0.78 MGLL (0.50) ENPP2L3MBTL1KDM4EATMHTR7
SCHEMBL29520112 0.77 ENPP2 (0.57) ENPP2L3MBTL1KDM4EATM
SCHEMBL16296743 0.77 ENPP2 (0.57) ENPP2L3MBTL1KDM4EATM
SCHEMBL17227962 0.77 ATM (0.59) L3MBTL1KDM4EATMHTR7COMT
SCHEMBL16674362 0.77 ATM (0.59) L3MBTL1KDM4EATMHTR7COMT
SCHEMBL29367591 0.77 ATM (0.64) L3MBTL1KDM4EATMHTR7HTR1A
SCHEMBL29432855 0.77 ATM (0.64) L3MBTL1KDM4EATMHTR7HTR1A
SCHEMBL29384509 0.77 ATM (0.64) L3MBTL1KDM4EATMHTR7HTR1A

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
CN-110590770-A Triazolopyridine-based organic electroluminescent material and organic electroluminescent device 武汉尚赛光电科技有限公司 2019-12-20 CN disclosed