SCHEMBL25965469

SCHEMBL25965469

c1ccc(-c2ccc(-c3nc(-c4ccc(-n5c6ccccc6c6ccc7c(c8ccccc8n7-c7ccccc7)c65)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGER4 P35408 2/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
LMNA P02545 1/20 0.32
MMP12 P39900 1/20 0.32
MMP13 P45452 1/20 0.32
HDAC4 P56524 1/20 0.31
AHR P35869 1/20 0.31
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 2/20 0.30
MAPT P10636 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TSHR P16473 1/20 0.30
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL25965454 1.00 KDM4E (0.37) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL25964756 0.99 KDM4E (0.38) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL25964780 0.99 KDM4E (0.38) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL22479852 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL25965453 0.96 KDM4E (0.35) KDM4EATML3MBTL1SMN1; SMN2LMNA
SCHEMBL25965464 0.96 KDM4E (0.35) KDM4EATML3MBTL1SMN1; SMN2LMNA
SCHEMBL24078494 0.95 KDM4E (0.36) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL19769906 0.95 KDM4E (0.33) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL22050477 0.95 KDM4E (0.36) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL20315858 0.95 PTGER4 (0.32) KDM4EATML3MBTL1PTGER4MMP12

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