SCHEMBL25244650

SCHEMBL25244650

COc1c(F)cccc1Nc1cc(Nc2cc(C)nc(C)n2)ncn1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 17/20 0.59
▸ POLB P06746 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ JAK1 P23458 1/20 0.44
▸ MAPT P10636 1/20 0.42
▸ RECQL P46063 1/20 0.42

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
SCHEMBL25288885 0.88 POLB (0.48) TYK2POLBGAAJAK1MAPT
SCHEMBL25242554 0.87 POLB (0.47) TYK2POLBGAAJAK1
SCHEMBL25286198 0.86 TYK2 (0.45) TYK2POLBGAAJAK1MAPT
SCHEMBL25288507 0.86 POLB (0.46) TYK2POLBGAAJAK1MAPT
SCHEMBL25288626 0.85 TYK2 (0.45) TYK2POLBGAAJAK1
SCHEMBL25283977 0.85 TYK2 (0.50) TYK2POLBGAAJAK1
SCHEMBL25292550 0.83 TYK2 (0.44) TYK2POLBGAAJAK1
SCHEMBL25242097 0.81 TYK2 (0.52) TYK2POLBGAAJAK1
SCHEMBL25293421 0.81 GAA (0.53) TYK2POLBGAAJAK1MAPT
SCHEMBL25283961 0.78 EGFR (0.48) TYK2POLBGAAJAK1MAPT

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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