SCHEMBL25964745

SCHEMBL25964745

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c7ccccc7n(-c7ccccc7)c6ccc54)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.36
LMNA P02545 1/20 0.36
PTGER4 P35408 1/20 0.35
AHR P35869 1/20 0.35
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HPGD P15428 2/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
POLB P06746 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HCRTR1 O43613 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
BRCA1 P38398 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
SCHEMBL25965446 0.99 KDM4E (0.38) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL19799332 0.95 KDM4E (0.37) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL25964737 0.95 KDM4E (0.37) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL22352382 0.95 L3MBTL1 (0.39) KDM4EL3MBTL1ATMPTGER4ALDH1A1
SCHEMBL24078492 0.94 KDM4E (0.39) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL18126039 0.94 KDM4E (0.36) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL22050469 0.94 KDM4E (0.36) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL26146639 0.94 KDM4E (0.36) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL20315779 0.94 PTGER4 (0.34) KDM4EL3MBTL1ATMSMN1; SMN2LMNA
SCHEMBL25965444 0.94 KDM4E (0.36) KDM4EL3MBTL1ATMSMN1; SMN2LMNA

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