Sugi Predict

Sugi Predict / Compounds / SCHEMBL29563044

SCHEMBL29563044

SCHEMBL29563044

CO[C@@]1(c2cc(C)cc(-c3cc(C)n4cnc(NC(N)=O)cc34)n2)CCOC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 16/20 1.00
▸ JAK2 O60674 2/20 1.00
▸ JAK1 P23458 1/20 0.54

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
SCHEMBL29563806 1.00 TYK2 (1.00) TYK2JAK2JAK1
SCHEMBL29563160 0.95 TYK2 (0.91) TYK2JAK2JAK1
SCHEMBL29563732 0.92 TYK2 (0.86) TYK2JAK2JAK1
SCHEMBL29562928 0.90 TYK2 (0.82) TYK2JAK2JAK1
SCHEMBL29563240 0.90 TYK2 (0.82) TYK2JAK2JAK1
SCHEMBL29563006 0.89 TYK2 (0.80) TYK2JAK2JAK1
SCHEMBL29563185 0.89 TYK2 (0.80) TYK2JAK2JAK1
SCHEMBL29563091 0.88 TYK2 (0.78) TYK2JAK2JAK1
SCHEMBL29563245 0.88 TYK2 (0.78) TYK2JAK2JAK1
SCHEMBL29563023 0.87 TYK2 (0.76) TYK2JAK2JAK1

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-2022109580-A1 INHIBITION OF TYK2 DEPENDENT SIGNALING PATHWAYS JANSSEN PHARMACEUTICA NV (BE) 2022-05-27 — — WO disclosed
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