SCHEMBL25965889

SCHEMBL25965889

c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2ccc(-c3nc(-c4ccc5c(c4)oc4ccccc45)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTGER4 P35408 2/20 0.35
AHR P35869 2/20 0.34
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
HCRTR1 O43613 1/20 0.33
LMNA P02545 1/20 0.33
MMP12 P39900 1/20 0.32
MMP13 P45452 1/20 0.32
PTPN1 P18031 1/20 0.32
TTR P02766 1/20 0.32
HDAC4 P56524 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 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
SCHEMBL19769833 0.98 KDM4E (0.41) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL23601946 0.98 KDM4E (0.43) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL25965850 0.97 KDM4E (0.40) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL22049450 0.97 KDM4E (0.37) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL23602221 0.97 KDM4E (0.40) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL25964766 0.95 KDM4E (0.43) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL25965891 0.95 KDM4E (0.43) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL19769736 0.94 KDM4E (0.40) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL25965461 0.94 KDM4E (0.42) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL22049448 0.94 ATM (0.38) KDM4EATML3MBTL1PTGER4AHR

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
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed