SCHEMBL25248111

SCHEMBL25248111

COc1c(Nc2cc(Nc3cc(C)nc(C)n3)ncn2)cccc1-c1nc(C)n(C)n1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.65
▸ JAK1 P23458 1/20 0.53
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40

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
SCHEMBL25246327 0.88 TYK2 (0.52) TYK2JAK1
SCHEMBL25289314 0.86 TYK2 (0.69) TYK2JAK1
SCHEMBL25242097 0.86 TYK2 (0.52) TYK2JAK1POLBGAA
SCHEMBL25293427 0.85 TYK2 (0.51) TYK2JAK1
SCHEMBL25242518 0.85 TYK2 (0.55) TYK2JAK1
SCHEMBL25286958 0.85 TYK2 (0.49) TYK2JAK1POLBGAA
SCHEMBL25239739 0.84 TYK2 (0.48) TYK2JAK1POLBGAA
SCHEMBL25288885 0.83 POLB (0.48) TYK2JAK1POLBGAA
SCHEMBL25283977 0.82 TYK2 (0.50) TYK2JAK1POLBGAA
SCHEMBL25241803 0.82 TYK2 (0.55) TYK2JAK1

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
Send feedback