SCHEMBL25845956

SCHEMBL25845956

c1ccc2c(c1)Sc1cc(-c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4ccccc43)cc3cccc-2c13

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
SCHEMBL25845719 0.96 TYMS (0.33) TYMS
SCHEMBL25845954 0.95 ALDH1A1 (0.33) TYMS
SCHEMBL25846651 0.94 TYMS (0.36) TYMS
SCHEMBL25845588 0.93 KDM4E (0.35) TYMS
SCHEMBL25845961 0.92 PDK2 (0.33) TYMS
SCHEMBL25846445 0.91 TYMS (0.36) TYMS
SCHEMBL25863460 0.90 PDK2 (0.33) TYMS
SCHEMBL25845822 0.90 PDK2 (0.33) TYMS
SCHEMBL25845721 0.90 TYMS (0.31) TYMS
SCHEMBL25846645 0.89 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