SCHEMBL28956162

SCHEMBL28956162

C#CC(C)(O)c1cc(C(F)(F)F)ncn1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.44
▸ CHKA P35790 1/20 0.44

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
SCHEMBL30282364 1.00 CA2 (0.44) CA2CHKA
SCHEMBL25207482 0.80 KMT2A (0.30) —
SCHEMBL28956074 0.78 — —
SCHEMBL30282397 0.78 — —
SCHEMBL25217067 0.76 CYP2C19 (0.35) —
SCHEMBL31708045 0.76 CYP2C19 (0.35) —
SCHEMBL27264896 0.76 CA2 (0.68) CA2CHKA
SCHEMBL25218748 0.74 CA2 (0.38) CA2CHKA
SCHEMBL30307739 0.74 CA2 (0.38) CA2CHKA
SCHEMBL10197318 0.74 CA2 (0.56) CA2CHKA

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-115551841-A Azetidin-3-ylcarbinol derivatives as modulators of the CCR6 receptor 爱杜西亚药品有限公司 2022-12-30 — — CN disclosed
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