SCHEMBL25243233

SCHEMBL25243233

Cc1cc(Nc2cc(Nc3ccccc3-c3ncn(C)n3)ncn2)nc(C)n1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 16/20 0.54
▸ JAK1 P23458 2/20 0.54
▸ POLB P06746 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ AKR1C3 P42330 1/20 0.40
▸ MAPT P10636 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38

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
SCHEMBL25289314 0.89 TYK2 (0.69) TYK2JAK1KCNH2
SCHEMBL25242045 0.87 TYK2 (0.58) TYK2JAK1KCNH2
SCHEMBL25294035 0.84 TYK2 (0.56) TYK2JAK1KCNH2
SCHEMBL25243960 0.80 TYK2 (0.54) TYK2JAK1AKR1C3KCNH2
SCHEMBL25243633 0.79 TYK2 (0.47) TYK2JAK1
SCHEMBL25244793 0.78 TYK2 (0.57) TYK2JAK1KCNH2
SCHEMBL25251672 0.78 TYK2 (0.51) TYK2JAK1KCNH2
SCHEMBL25282307 0.78 TYK2 (0.54) TYK2JAK1
SCHEMBL25242097 0.76 TYK2 (0.52) TYK2JAK1POLBGAA
SCHEMBL25293421 0.73 GAA (0.53) TYK2JAK1POLBGAAMAPT

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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