SCHEMBL31084202

SCHEMBL31084202

CNc1cc(Nc2cccnc2OC)nc2c(C(=O)N[C@H]3CCC[C@@H]3O)cnn12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 1.00
▸ PDE4D Q08499 1/20 0.79

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
SCHEMBL21238777 1.00 TYK2 (1.00) TYK2PDE4D
SCHEMBL20678824 1.00 TYK2 (1.00) TYK2PDE4D
SCHEMBL20687920 1.00 TYK2 (1.00) TYK2PDE4D
SCHEMBL20678808 1.00 TYK2 (1.00) TYK2PDE4D
SCHEMBL20688344 1.00 TYK2 (1.00) TYK2PDE4D
SCHEMBL21726388 0.95 TYK2 (1.00) TYK2PDE4D
SCHEMBL20689608 0.95 TYK2 (1.00) TYK2PDE4D
SCHEMBL20687771 0.95 TYK2 (1.00) TYK2PDE4D
SCHEMBL20678926 0.95 TYK2 (1.00) TYK2PDE4D
SCHEMBL20688793 0.95 TYK2 (1.00) TYK2PDE4D

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4438117-A2 TYK2 INHIBITORS AND USES THEREOF Takeda Pharmaceutical Company Limited (JP) 2024-10-02 — — EP disclosed
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