SCHEMBL25870521

SCHEMBL25870521

c1ccc2c(c1)-c1c(-c3ccc(-c4ccc5c(c4)-c4cccc6cccc(c46)S5)cc3)cccc1C21c2ccccc2-c2cccc3cccc1c23

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.35

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
SCHEMBL25870625 0.98 TYMS (0.37) TYMS
SCHEMBL25844528 0.95 TYMS (0.37) TYMS
SCHEMBL25870366 0.94 TYMS (0.35) TYMS
SCHEMBL25844909 0.93 TYMS (0.39) TYMS
SCHEMBL25870623 0.92 ALDH1A1 (0.33) TYMS
SCHEMBL25870373 0.92 TYMS (0.36) TYMS
SCHEMBL25870173 0.92 TYMS (0.36) TYMS
SCHEMBL25844531 0.90 TYMS (0.39) TYMS
SCHEMBL25870628 0.89 TYMS (0.33) TYMS
SCHEMBL25844900 0.88 TYMS (0.41) 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