SCHEMBL25408643

SCHEMBL25408643

CCn1cc(Nc2ncc(C)c(-c3c[nH]c4c(NC(=O)C(C)N5CCN(C)CC5)cccc34)n2)c(OC)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 17/20 1.00
▸ JAK2 O60674 16/20 1.00
▸ JAK3 P52333 2/20 0.74
▸ KCNH2 Q12809 2/20 0.74

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
SCHEMBL29394798 1.00 JAK1 (1.00) JAK1JAK2JAK3KCNH2
SCHEMBL18662700 1.00 JAK1 (1.00) JAK1JAK2JAK3KCNH2
SCHEMBL18662608 0.95 JAK1 (1.00) JAK1JAK2
SCHEMBL25408449 0.95 JAK1 (1.00) JAK1JAK2
SCHEMBL29394390 0.95 JAK1 (1.00) JAK1JAK2
SCHEMBL18662622 0.92 JAK1 (1.00) JAK1JAK2JAK3KCNH2
SCHEMBL18662595 0.92 JAK1 (1.00) JAK1JAK2JAK3KCNH2
SCHEMBL25407870 0.92 JAK1 (1.00) JAK1JAK2JAK3KCNH2
SCHEMBL29394452 0.92 JAK1 (1.00) JAK1JAK2JAK3KCNH2
SCHEMBL29394440 0.92 JAK1 (1.00) JAK1JAK2JAK3KCNH2

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-3353168-B1 COMPOUNDS AND METHODS FOR INHIBITING JAK DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2023-08-30 — — EP claimed
EP-4219482-A1 COMPOUNDS AND METHODS FOR INHIBITING JAK DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-08-02 — — EP disclosed
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