SCHEMBL29563620

SCHEMBL29563620

COC1(c2cc(O)cc(Br)n2)CCOC1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 16/20 0.38
▸ JAK2 O60674 2/20 0.38
▸ ALOX5 P09917 4/20 0.37
▸ JAK1 P23458 1/20 0.37

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
SCHEMBL29562567 1.00 TYK2 (0.38) TYK2JAK2ALOX5JAK1
SCHEMBL29562736 1.00 TYK2 (0.38) TYK2JAK2ALOX5JAK1
SCHEMBL29563632 0.92 ALOX5 (0.39) TYK2JAK2ALOX5JAK1
SCHEMBL29562794 0.84 TYK2 (0.45) TYK2JAK2ALOX5JAK1
SCHEMBL21329689 0.84 TYK2 (0.45) TYK2JAK2ALOX5JAK1
SCHEMBL21330284 0.84 TYK2 (0.45) TYK2JAK2ALOX5JAK1
SCHEMBL21329691 0.84 TYK2 (0.45) TYK2JAK2ALOX5JAK1
SCHEMBL29562754 0.84 TYK2 (0.45) TYK2JAK2ALOX5JAK1
SCHEMBL21329659 0.83 TYK2 (0.38) TYK2JAK2ALOX5JAK1
SCHEMBL31161395 0.83 TYK2 (0.36) TYK2JAK2ALOX5JAK1

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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