SCHEMBL25251672

SCHEMBL25251672

COc1c(Nc2cc(Nc3cc(C)nc(C)n3)ncn2)ccc(F)c1-c1ncn(C)n1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.51
▸ JAK1 P23458 2/20 0.51
▸ KCNH2 Q12809 1/20 0.41

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
SCHEMBL25243960 0.91 TYK2 (0.54) TYK2JAK1KCNH2
SCHEMBL25294035 0.85 TYK2 (0.56) TYK2JAK1KCNH2
SCHEMBL25289314 0.84 TYK2 (0.69) TYK2JAK1KCNH2
SCHEMBL25286198 0.81 TYK2 (0.45) TYK2JAK1
SCHEMBL25243633 0.80 TYK2 (0.47) TYK2JAK1
SCHEMBL25243233 0.78 TYK2 (0.54) TYK2JAK1KCNH2
SCHEMBL25282307 0.77 TYK2 (0.54) TYK2JAK1
SCHEMBL25244650 0.77 TYK2 (0.59) TYK2JAK1
SCHEMBL25242045 0.77 TYK2 (0.58) TYK2JAK1KCNH2
SCHEMBL25244793 0.74 TYK2 (0.57) TYK2JAK1KCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4206196-A1 PYRIMIDINE SUBSTITUTED DERIVATIVES AS TYK2 INHIBITORS Almirall S.A. (ES) 2023-07-05 — — EP claimed
EP-4206196-A1 PYRIMIDINE SUBSTITUTED DERIVATIVES AS TYK2 INHIBITORS Almirall S.A. (ES) 2023-07-05 — — EP disclosed
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