SCHEMBL30349436

SCHEMBL30349436

CNc1cc(Nc2ccccc2OC)nc2c(C(=O)N[C@@H]3CCN(C)C3=O)cnn12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 1.00
▸ STAT3 P40763 4/20 1.00
▸ PDE4D Q08499 1/20 0.59

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
SCHEMBL21811269 1.00 TYK2 (1.00) TYK2STAT3PDE4D
SCHEMBL21811163 1.00 TYK2 (1.00) TYK2STAT3PDE4D
SCHEMBL21887776 1.00 TYK2 (1.00) TYK2STAT3PDE4D
SCHEMBL21887515 0.91 TYK2 (0.84) TYK2STAT3PDE4D
SCHEMBL21811321 0.91 TYK2 (0.84) TYK2STAT3PDE4D
SCHEMBL21811186 0.91 TYK2 (0.84) TYK2STAT3PDE4D
SCHEMBL30349300 0.91 TYK2 (0.84) TYK2STAT3PDE4D
SCHEMBL21887376 0.89 TYK2 (0.81) TYK2STAT3
SCHEMBL30349442 0.87 TYK2 (0.77) TYK2STAT3PDE4D
SCHEMBL22342898 0.86 TYK2 (0.77) TYK2STAT3PDE4D

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
CN-112638915-B Pyrazolo [1,5-a ] pyrimidine-3-carboxamide derivatives for the treatment of psoriasis and systemic lupus erythematosus 伊莱利利公司 2023-04-07 — — CN disclosed
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