SCHEMBL25965896

SCHEMBL25965896

c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccc(-c5nc(-c6ccc7c(c6)oc6ccccc67)nc(-n6c7ccccc7c7ccccc76)n5)cc4)c23)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTGER4 P35408 2/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
LMNA P02545 1/20 0.32
AHR P35869 1/20 0.30
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL24078494 1.00 KDM4E (0.36) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL19769905 0.97 KDM4E (0.34) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL26055258 0.97 PTGER4 (0.32) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL24800909 0.97 KDM4E (0.35) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL22479852 0.97 KDM4E (0.38) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL24802401 0.96 KDM4E (0.36) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL20315858 0.96 PTGER4 (0.32) KDM4EATML3MBTL1PTGER4AHR
SCHEMBL19769906 0.96 KDM4E (0.33) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL25964756 0.96 KDM4E (0.38) KDM4EATML3MBTL1PTGER4SMN1; SMN2
SCHEMBL25964780 0.96 KDM4E (0.38) KDM4EATML3MBTL1PTGER4SMN1; SMN2

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