SCHEMBL29562916

SCHEMBL29562916

CCOC(=O)c1cc2c(-c3cc(C)cc([C@]4(OC)CCOC4)n3)cc(-c3cnn(C)c3)n2cn1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 16/20 0.52
▸ JAK2 O60674 2/20 0.52
▸ JAK1 P23458 1/20 0.38
▸ FGFR1 P11362 4/20 0.34
▸ FGFR2 P21802 4/20 0.34
▸ FGFR4 P22455 4/20 0.34
▸ FGFR3 P22607 4/20 0.34
▸ KDR P35968 4/20 0.34

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
SCHEMBL29562740 1.00 TYK2 (0.52) TYK2JAK2JAK1FGFR1FGFR2
SCHEMBL29563042 0.91 TYK2 (0.55) TYK2JAK2JAK1FGFR1FGFR2
SCHEMBL29563338 0.86 TYK2 (0.69) TYK2JAK2JAK1
SCHEMBL29562969 0.86 TYK2 (0.69) TYK2JAK2JAK1
SCHEMBL29562765 0.85 TYK2 (0.58) TYK2JAK2JAK1
SCHEMBL29562864 0.85 TYK2 (0.58) TYK2JAK2JAK1
SCHEMBL29562781 0.85 TYK2 (0.54) TYK2JAK2JAK1FGFR1FGFR2
SCHEMBL29562878 0.85 TYK2 (0.54) TYK2JAK2JAK1FGFR1FGFR2
SCHEMBL29563348 0.85 TYK2 (0.65) TYK2JAK2JAK1
SCHEMBL29562665 0.85 TYK2 (0.65) 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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