SCHEMBL25845144

SCHEMBL25845144

c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4cccc5c4-c4cccc6cccc(c46)S5)cccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.41
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL25861266 0.93 TYMS (0.42) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25845267 0.90 TYMS (0.45) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25855464 0.88 MEN1 (0.39) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25846994 0.88 TYMS (0.41) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25846200 0.86 TYMS (0.36) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25853814 0.86 TYMS (0.35) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25845132 0.86 TYMS (0.41) TYMSALDH1A1TSHRMAPK1ATM
SCHEMBL25861329 0.86 TYMS (0.37) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25861334 0.86 TYMS (0.37) TYMSLMNAKDM4EMEN1MAPT
SCHEMBL25845263 0.84 TYMS (0.45) TYMSLMNAKDM4EMEN1MAPT

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