SCHEMBL31280055

SCHEMBL31280055

COc1c(-c2cnn(C)n2)ccnc1Nc1cc(NC(=O)C2CC2)ncc1C(C)(F)F

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.56
▸ TYK2 P29597 17/20 0.50
▸ JAK1 P23458 3/20 0.44
▸ CYP2C19 P33261 1/20 0.42

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
SCHEMBL31280374 0.92 JAK2 (0.56) JAK2TYK2JAK1
SCHEMBL31280222 0.90 TYK2 (0.56) JAK2TYK2JAK1CYP2C19
SCHEMBL24775864 0.85 JAK2 (0.75) JAK2TYK2JAK1CYP2C19
SCHEMBL29947332 0.85 JAK2 (0.75) JAK2TYK2JAK1CYP2C19
SCHEMBL30079429 0.83 TYK2 (0.62) JAK2TYK2JAK1
SCHEMBL24823051 0.83 TYK2 (0.62) JAK2TYK2JAK1
SCHEMBL31280405 0.81 JAK2 (0.56) JAK2TYK2JAK1CYP2C19
SCHEMBL30079529 0.80 TYK2 (0.76) JAK2TYK2JAK1
SCHEMBL30079131 0.77 TYK2 (0.75) JAK2TYK2JAK1
SCHEMBL24776106 0.76 JAK2 (0.70) JAK2TYK2JAK1CYP2C19

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4727941-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF Lynk Pharmaceuticals Co. Ltd. (CN) 2026-04-22 — — EP disclosed
WO-2024255885-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-12-19 — — WO disclosed
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