SCHEMBL28896186

SCHEMBL28896186

CCOC(=O)NC(=S)N(CCOC1(C(F)(F)F)CCOC1)c1cc[nH]c1C(=O)OCC

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 1/20 0.30

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
SCHEMBL28896565 0.89 CA12 (0.31) ADORA2B
SCHEMBL28896615 0.89 CA12 (0.31) ADORA2B
SCHEMBL28896539 0.89 CA12 (0.30) ADORA2B
SCHEMBL28896225 0.82 ADORA2B (0.31) ADORA2B
SCHEMBL28896496 0.82 ATM (0.34)
SCHEMBL29211265 0.81 CA12 (0.30)
SCHEMBL28896332 0.77 CA12 (0.35)
SCHEMBL28896317 0.77 ALDH1A1 (0.33) ADORA2B
SCHEMBL28896607 0.74 ATM (0.38)
SCHEMBL21530683 0.74 KMT2A (0.39)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115403584-B 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
CN-115403584-A 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-29 CN disclosed