SCHEMBL20193170

SCHEMBL20193170

Cc1ccc(S(=O)(=O)n2cc(-c3cnn(COCCS(C)(C)C)c3)c3cc(C#CC(C)(O)c4nccs4)ncc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHUK O15111 14/20 0.48
MAP3K14 Q99558 6/20 0.33

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
SCHEMBL16608297 0.92 CHUK (0.48) CHUKMAP3K14
SCHEMBL20193233 0.89 CHUK (0.49) CHUKMAP3K14
SCHEMBL19114676 0.85 CHUK (0.66) CHUKMAP3K14
SCHEMBL16608290 0.81 CHUK (0.47) CHUKMAP3K14
SCHEMBL20193240 0.79 CHUK (0.61) CHUK
SCHEMBL19629575 0.79 L3MBTL1 (0.36) CHUKMAP3K14
SCHEMBL20193178 0.78 L3MBTL1 (0.39)
SCHEMBL19114586 0.77 CHUK (0.69) CHUK
SCHEMBL16608623 0.76 CHUK (0.67) CHUKMAP3K14
SCHEMBL20193158 0.75 CHUK (0.50) CHUK

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
US-9981963-B2 3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-c]pyridine derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2018-05-29 US disclosed