SCHEMBL23849720

SCHEMBL23849720

Cc1cnc(Nc2cc(Nc3ccccc3S(C)(=O)=O)c3nc(C)[nH]c3n2)cn1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 20/20 0.50
JAK2 O60674 4/20 0.46
JAK1 P23458 4/20 0.46
KCNH2 Q12809 3/20 0.46
KIT P10721 1/20 0.43

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
SCHEMBL21493320 0.88 TYK2 (0.47) TYK2JAK2JAK1KCNH2KIT
SCHEMBL23849706 0.88 TYK2 (0.65) TYK2JAK2JAK1KCNH2KIT
SCHEMBL20093260 0.88 TYK2 (0.54) TYK2
SCHEMBL21493382 0.88 TYK2 (0.57) TYK2JAK2JAK1
SCHEMBL21493372 0.87 TYK2 (0.44) TYK2JAK2JAK1KCNH2KIT
SCHEMBL21493307 0.86 TYK2 (0.66) TYK2JAK2JAK1KCNH2KIT
SCHEMBL20112997 0.86 TYK2 (0.60) TYK2JAK2JAK1KCNH2KIT
SCHEMBL29707508 0.86 TYK2 (0.60) TYK2JAK2JAK1KCNH2KIT
SCHEMBL23849736 0.85 TYK2 (0.57) TYK2
SCHEMBL21493338 0.85 TYK2 (0.63) TYK2

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
EP-3532473-B1 HETEROBICYCLIC COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2021-09-29 EP disclosed