SCHEMBL30529610

SCHEMBL30529610

CCN1C[C@@H](NC(=O)c2cnc3c(N(C)Cc4ccc(OC)cc4)cc(Nc4cccn(C5CCC(OC)CC5)c4=O)nn23)C1=O

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.51

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
SCHEMBL31245734 0.88 TYK2 (0.52) TYK2
SCHEMBL25364124 0.87 TYK2 (0.48) TYK2
SCHEMBL25363454 0.86 TYK2 (0.69) TYK2
SCHEMBL31245704 0.84 TYK2 (0.49) TYK2
SCHEMBL16794722 0.82 TYK2 (0.60) TYK2
SCHEMBL25362399 0.80 PDE1B (0.34) TYK2
SCHEMBL25362408 0.80 PDE1B (0.34) TYK2
SCHEMBL16794602 0.78 TYK2 (0.54) TYK2
SCHEMBL31245737 0.78 TYK2 (0.46) TYK2
SCHEMBL26099848 0.77 TYK2 (0.47) TYK2

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
WO-2023155900-A1 FIVE-MEMBERED AND SIX-MEMBERED HETEROCYCLIC COMPOUND, AND USE THEREOF AS PROTEIN KINASE INHIBITOR 上海轶诺药业有限公司 2023-08-24 — — WO disclosed
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