SCHEMBL20232138

SCHEMBL20232138

c1ccc(-c2ccc3c(c2)c2ccccc2c2ccccc2c2cc(-c4ccccc4)ccc2n3-c2ccc3c4ccccc4c4ccccc4c3c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TSPO P30536 1/20 0.39
NR4A2 P43354 2/20 0.38
NR3C1 P04150 1/20 0.37
EDNRB P24530 1/20 0.36
EDNRA P25101 1/20 0.36
HDAC4 P56524 1/20 0.36
RAC2 P15153 1/20 0.35
RAC3 P60763 1/20 0.35
CDC42 P60953 1/20 0.35
RAC1 P63000 1/20 0.35
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
LDHA P00338 1/20 0.34
MAOB P27338 1/20 0.34
JAK2 O60674 2/20 0.33
ALOX5 P09917 1/20 0.33
DNM1 Q05193 1/20 0.33

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
SCHEMBL18675906 1.00 KDM4E (0.42) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL16373519 1.00 KDM4E (0.42) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL17915831 0.97 L3MBTL1 (0.48) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL27309875 0.97 L3MBTL1 (0.48) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL20232127 0.97 L3MBTL1 (0.48) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL23156756 0.97 L3MBTL1 (0.48) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL16405426 0.95 L3MBTL1 (0.52) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL21034917 0.95 KDM4E (0.39) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL21883301 0.95 L3MBTL1 (0.52) KDM4EATML3MBTL1TSPONR4A2
SCHEMBL15479765 0.95 L3MBTL1 (0.52) KDM4EATML3MBTL1TSPONR4A2

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
EP-3548481-B1 HETEROCYCLIC COMPOUNDS FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed
WO-2018100029-A1 HETEROCYCLIC COMPOUNDS FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-06-07 WO disclosed