SCHEMBL20093115

SCHEMBL20093115

CC(C)c1ccc(Nc2cc(Nc3ccccc3S(C)(=O)=O)c3nc(C(F)F)n(C4CCCCO4)c3n2)nc1C#N

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 20/20 0.56

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
SCHEMBL20092417 0.91 TYK2 (0.56) TYK2
SCHEMBL20092678 0.88 TYK2 (0.54) TYK2
SCHEMBL20092563 0.88 TYK2 (0.48) TYK2
SCHEMBL20092703 0.86 TYK2 (0.51) TYK2
SCHEMBL20093199 0.84 TYK2 (0.53) TYK2
SCHEMBL20092734 0.83 TYK2 (0.58) TYK2
SCHEMBL20092557 0.83 TYK2 (0.54) TYK2
SCHEMBL20156108 0.82 TYK2 (0.51) TYK2
SCHEMBL20093299 0.82 TYK2 (0.56) TYK2
SCHEMBL20093230 0.82 TYK2 (0.68) 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
WO-2018075937-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2018-04-26 WO disclosed