SCHEMBL27423017

SCHEMBL27423017

COc1c(Nc2nc(Nc3cnn(C(C)C)c3)ncc2C(=O)N(C)C)cccc1-c1ncn(C)n1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 16/20 0.50
▸ TYK2 P29597 12/20 0.50
▸ JAK3 P52333 10/20 0.50
▸ JAK2 O60674 9/20 0.50
▸ KCNH2 Q12809 3/20 0.43
▸ STAT3 P40763 1/20 0.41
▸ AXL P30530 1/20 0.41

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
SCHEMBL31711651 1.00 JAK1 (0.50) JAK1TYK2JAK3JAK2KCNH2
SCHEMBL27419039 0.92 JAK1 (0.52) JAK1TYK2JAK3JAK2KCNH2
SCHEMBL31711623 0.92 JAK1 (0.52) JAK1TYK2JAK3JAK2KCNH2
SCHEMBL27414754 0.91 JAK3 (0.62) JAK1TYK2JAK3JAK2
SCHEMBL31711661 0.91 JAK3 (0.62) JAK1TYK2JAK3JAK2
SCHEMBL27415323 0.91 JAK3 (0.51) JAK1TYK2JAK3JAK2AXL
SCHEMBL31711674 0.88 JAK1 (0.53) JAK1TYK2JAK3JAK2KCNH2
SCHEMBL27419137 0.88 JAK1 (0.53) JAK1TYK2JAK3JAK2KCNH2
SCHEMBL31711659 0.83 JAK1 (0.51) JAK1TYK2JAK3JAK2KCNH2
SCHEMBL27420290 0.83 JAK1 (0.51) JAK1TYK2JAK3JAK2KCNH2

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-2024137548-A2 INHIBITORS OF JAK2 Llydaw Therapeutics, Inc. (US) 2024-06-27 — — WO disclosed
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