SCHEMBL28176820

SCHEMBL28176820

CCCCc1cc2c3c(cccc3c1)C(=O)OC2=O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 12/20 0.51
▸ TDP1 Q9NUW8 1/20 0.41
▸ PSMB5 P28074 1/20 0.37
▸ CYP1B1 Q16678 1/20 0.37

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
SCHEMBL6389316 0.77 TYMS (0.36) TYMSPSMB5
SCHEMBL13829361 0.75 TYMS (0.46) TYMSTDP1
SCHEMBL6412562 0.74 SKP2 (0.43) TDP1PSMB5
SCHEMBL29713399 0.74 TYMS (0.45) TYMSTDP1CYP1B1
SCHEMBL21631279 0.74 TYMS (0.45) TYMSTDP1CYP1B1
SCHEMBL19985728 0.73 TDP1 (0.51) TDP1CYP1B1
SCHEMBL7709982 0.73 TYMS (0.64) TYMSTDP1
Phthalic Anhydride SCHEMBL29186893 0.73 TDP1 (0.52) TDP1
SCHEMBL6390631 0.72 PTPRB (0.35) TYMS
SCHEMBL7709455 0.72 TYMS (0.53) TYMSCYP1B1

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
CN-107250114-A Sulfonic acid derivative compound, photoacid generator, resist composition, cationic polymerization initiator, and cationically polymerizable composition 株式会社ADEKA 2017-10-13 — — CN disclosed
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