SCHEMBL29134815

SCHEMBL29134815

CS(=O)(=O)NC1COc2cc(Br)cc(F)c21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.32

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
SCHEMBL29134906 0.78 MTNR1A (0.37) —
SCHEMBL29134891 0.76 RIPK1 (0.32) —
SCHEMBL31120631 0.69 KDM1A (0.35) —
SCHEMBL31120659 0.69 — —
SCHEMBL30016328 0.69 KDM1A (0.35) —
SCHEMBL29134322 0.64 ADRA2A (0.42) CA2
SCHEMBL31120566 0.63 — —
SCHEMBL1473426 0.61 HTR6 (0.39) —
SCHEMBL24698005 0.61 ADRA2A (0.42) CA2
SCHEMBL5862840 0.61 MALT1 (0.47) CA2

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-117120429-A KHK inhibitor 吉利德科学公司 2023-11-24 — — CN disclosed
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