SCHEMBL29634603

SCHEMBL29634603

OB(O)c1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
ATM Q13315 2/20 0.46
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
COMT P21964 1/20 0.38
TRPV1 Q8NER1 3/20 0.37
KMT2A Q03164 1/20 0.36
HDAC4 P56524 1/20 0.36
FAAH O00519 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
ENPP2 Q13822 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
SCHEMBL17539930 1.00 MGLL (0.50) MGLLCA1CA2ATMKDM4E
SCHEMBL12415352 0.94 MGLL (0.49) MGLLCA1CA2ATMKDM4E
SCHEMBL18958489 0.90 MGLL (0.50) MGLLCA1CA2ATMKDM4E
SCHEMBL29669667 0.90 MGLL (0.50) MGLLCA1CA2ATMKDM4E
SCHEMBL30876793 0.90 MGLL (0.50) MGLLCA1CA2ATMKDM4E
SCHEMBL29949641 0.90 MGLL (0.50) MGLLCA1CA2ATMKDM4E
SCHEMBL14148357 0.90 MGLL (0.50) MGLLCA1CA2ATMKDM4E
SCHEMBL29976301 0.90 MGLL (0.50) MGLLCA1CA2ATMKDM4E
SCHEMBL2406420 0.89 MGLL (0.56) MGLLCA1CA2ATMKDM4E
SCHEMBL16475872 0.87 MGLL (0.50) MGLLCA1CA2ATMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112521343-B Organic electroluminescent material and device thereof 北京八亿时空液晶科技股份有限公司 2022-10-14 CN disclosed
CN-109111411-B Light extraction layer material and application thereof 湖北尚赛光电材料有限公司 2022-06-14 CN disclosed