SCHEMBL25845138

SCHEMBL25845138

c1ccc2c(c1)-c1cc(-c3cccc4c3-c3cccc5cccc(c35)S4)ccc1C21c2ccccc2-c2ccc3ccccc3c21

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.33

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
SCHEMBL25861335 0.94 TYMS (0.34) TYMS
SCHEMBL25846190 0.91 TYMS (0.31) TYMS
SCHEMBL25845252 0.90 TYMS (0.34) TYMS
SCHEMBL25845258 0.89 TYMS (0.40) TYMS
SCHEMBL25844532 0.88 TYMS (0.33) TYMS
SCHEMBL25844537 0.88 TYMS (0.34) TYMS
SCHEMBL25844227 0.88 TYMS (0.34) TYMS
SCHEMBL25845135 0.88 TYMS (0.37) TYMS
SCHEMBL25845140 0.87 TYMS (0.33) TYMS
SCHEMBL25846986 0.87 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