SCHEMBL25868271

SCHEMBL25868271

c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(-c4ccccc4-c4ccc5c(c4)-c4cccc6cccc(c46)O5)cc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
MAPK1 P28482 1/20 0.48
ATM Q13315 1/20 0.48
TYMS P04818 1/20 0.35
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDK2 Q15119 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
SCHEMBL25842884 0.96 KDM4E (0.49) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25868724 0.95 KDM4E (0.48) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25868279 0.93 MAPK1 (0.53) KDM4EMAPK1ATMTYMSPDK2
SCHEMBL25859892 0.92 MAPK1 (0.51) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25843526 0.91 MAPK1 (0.50) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25855645 0.91 MAPK1 (0.50) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25868142 0.91 MAPK1 (0.50) KDM4EMAPK1ATMTYMSPDK2
SCHEMBL25879006 0.90 KDM4E (0.43) KDM4EMAPK1ATMTYMSMEN1
SCHEMBL25860215 0.90 MAPK1 (0.47) KDM4EMAPK1ATMTYMSPDK2
SCHEMBL25841659 0.89 MAPK1 (0.54) KDM4EMAPK1ATMTYMSPDK2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed