SCHEMBL25845979

SCHEMBL25845979

c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(-c4ccc5cccc6c5c4-c4ccccc4S6)ccc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 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
TYMS P04818 1/20 0.32

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
SCHEMBL25846344 0.94 TYMS (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25846340 0.93 TYMS (0.35) TYMS
SCHEMBL25854892 0.92 TYMS (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25855646 0.92 MEN1 (0.37) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25854239 0.90 KDM4E (0.35) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25862123 0.90 TYMS (0.31) TYMS
SCHEMBL25846186 0.90 TYMS (0.33) TYMS
SCHEMBL25854554 0.89 KDM4E (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25846337 0.89 TYMS (0.31) TYMS
SCHEMBL25845131 0.88 TYMS (0.36) KDM4EMEN1LMNAMAPTOPRK1

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