SCHEMBL25844320

SCHEMBL25844320

c1ccc2c(c1)-c1c(-c3ccc4c(c3)Sc3cccc5cccc-4c35)cccc1C21c2ccccc2-c2c1ccc1ccccc21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.34
ANPEP P15144 1/20 0.32
DNMT1 P26358 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
SCHEMBL25861818 0.94 TYMS (0.33) TYMSANPEP
SCHEMBL25844312 0.92 TYMS (0.33) TYMSANPEP
SCHEMBL25844315 0.92 TYMS (0.33) TYMSANPEP
SCHEMBL25844735 0.91 TYMS (0.34) TYMSANPEP
SCHEMBL25853816 0.90 TYMS (0.32) TYMSANPEP
SCHEMBL25878207 0.89 TYMS (0.34) TYMSANPEP
SCHEMBL25845831 0.89 ANPEP (0.32) TYMSANPEP
SCHEMBL25844221 0.89 TYMS (0.37) TYMS
SCHEMBL25869094 0.88 ANPEP (0.31) ANPEP
SCHEMBL25861418 0.88 TYMS (0.33) TYMS

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