SCHEMBL25243202

SCHEMBL25243202

Cc1c(-c2cnc(Nc3cc(Nc4ccc(F)cn4)ncn3)c(N(C)S(C)(=O)=O)c2)cnn1C

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC34A1 Q06495 14/20 0.35
▸ MAPK10 P53779 1/20 0.34
▸ PIK3C3 Q8NEB9 1/20 0.33
▸ JAK2 O60674 2/20 0.33
▸ JAK1 P23458 2/20 0.33
▸ TYK2 P29597 2/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ KIT P10721 1/20 0.33
▸ STAT3 P40763 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ SCN9A Q15858 2/20 0.32

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
SCHEMBL25283606 0.89 TYK2 (0.34) SLC34A1PIK3C3JAK1TYK2
SCHEMBL25241283 0.87 PIK3C3 (0.34) PIK3C3TYK2
SCHEMBL25288932 0.87 TYK2 (0.38) PIK3C3JAK2JAK1TYK2KCNH2
SCHEMBL25249994 0.86 TYK2 (0.40) SLC34A1MAPK10JAK2JAK1TYK2
SCHEMBL25242170 0.83 TYK2 (0.39) PIK3C3TYK2
SCHEMBL25290634 0.80 TYK2 (0.43) PIK3C3TYK2
SCHEMBL25284264 0.79 MAP4K1 (0.47) PIK3C3TYK2
SCHEMBL25240241 0.78 TYK2 (0.34) PIK3C3TYK2
SCHEMBL25286994 0.73 TYK2 (0.31) PIK3C3TYK2
SCHEMBL25284327 0.72 TYK2 (0.43) 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 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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