SCHEMBL25855467

SCHEMBL25855467

c1ccc(C2(c3ccc(-c4cccc5c4Sc4cccc6cccc-5c46)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TYMS P04818 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL25854114 0.93 KDM4E (0.37) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25846817 0.91 TYMS (0.36) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25847108 0.91 TYMS (0.36) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25853920 0.91 TYMS (0.44) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25862283 0.90 TYMS (0.37) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25862344 0.89 TYMS (0.33) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25855790 0.89 TYMS (0.33) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25846996 0.88 TYMS (0.41) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25855471 0.88 MEN1 (0.37) MEN1KMT2ATYMSKDM4ELMNA
SCHEMBL25846994 0.87 TYMS (0.41) MEN1KMT2ATYMSKDM4ELMNA

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