SCHEMBL25248682

SCHEMBL25248682

Cc1cc(Nc2cc(Nc3ncc(-c4cc(C(F)(F)F)nn4C)cc3N(C)S(C)(=O)=O)ncn2)nc(C)n1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 5/20 0.36
▸ SLC34A1 Q06495 6/20 0.36
▸ STIM1 Q13586 1/20 0.34
▸ ORAI1 Q96D31 1/20 0.34
▸ PIK3C3 Q8NEB9 2/20 0.33
▸ MOGAT2 Q3SYC2 2/20 0.32
▸ ACAT1 P24752 1/20 0.32
▸ HTR1D P28221 1/20 0.32
▸ MGAT2 Q10469 1/20 0.32
▸ TMEM97 Q5BJF2 1/20 0.32
▸ RPS6KA1 Q15418 1/20 0.32
▸ PTK2 Q05397 1/20 0.31

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
SCHEMBL25242794 0.90 TYK2 (0.39) TYK2SLC34A1PIK3C3
SCHEMBL25241290 0.87 TYK2 (0.36) TYK2SLC34A1PIK3C3PTK2
SCHEMBL25288619 0.84 TYK2 (0.42) TYK2PIK3C3
SCHEMBL25283902 0.83 TYK2 (0.39) TYK2PIK3C3
SCHEMBL25288635 0.82 TYK2 (0.40) TYK2PIK3C3
SCHEMBL25287905 0.81 TYK2 (0.44) TYK2PIK3C3
SCHEMBL25289699 0.80 TYK2 (0.40) TYK2SLC34A1PIK3C3
SCHEMBL25242170 0.80 TYK2 (0.39) TYK2PIK3C3
SCHEMBL25238145 0.80 TYK2 (0.39) TYK2PIK3C3
SCHEMBL25288710 0.80 TYK2 (0.40) TYK2PIK3C3

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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