SCHEMBL25845973

SCHEMBL25845973

Cc1cccc2c1C1(c3ccccc3-2)c2ccccc2-c2c(-c3cc4c5c(cccc5c3)-c3ccccc3S4)cccc21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.31

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
SCHEMBL25845718 0.88 TYMS (0.34) TYMS
SCHEMBL25845720 0.86 ANPEP (0.31) TYMS
SCHEMBL25845966 0.85 TYMS (0.34) TYMS
SCHEMBL25845824 0.84 ALDH1A1 (0.35) TYMS
SCHEMBL25845825 0.84 TYMS (0.33) TYMS
SCHEMBL25846812 0.83 TYMS (0.39) TYMS
SCHEMBL25846443 0.82 TYMS (0.36) TYMS
SCHEMBL25845727 0.82 ANPEP (0.31) TYMS
SCHEMBL25845587 0.82 TYMS (0.35) TYMS
SCHEMBL25845831 0.81 ANPEP (0.32) 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