SCHEMBL18685106

SCHEMBL18685106

COc1nn(C)cc1Nc1ncc(C)c(-c2c[nH]c3c(N)cccc23)n1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 18/20 0.69
▸ JAK2 O60674 15/20 0.69
▸ JAK3 P52333 1/20 0.55
▸ KCNH2 Q12809 1/20 0.55

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
SCHEMBL29431103 1.00 JAK1 (0.69) JAK1JAK2JAK3KCNH2
SCHEMBL25368326 0.91 JAK1 (0.66) JAK1JAK2
SCHEMBL30480920 0.91 JAK1 (0.66) JAK1JAK2
SCHEMBL24474852 0.91 JAK1 (0.65) JAK1JAK2JAK3KCNH2
SCHEMBL24474853 0.90 JAK1 (0.65) JAK1JAK2JAK3KCNH2
SCHEMBL25368939 0.90 JAK1 (0.65) JAK1JAK2JAK3KCNH2
SCHEMBL25369936 0.89 JAK2 (0.63) JAK1JAK2
SCHEMBL26078108 0.88 JAK1 (0.70) JAK1JAK2JAK3KCNH2
SCHEMBL29431073 0.86 JAK1 (0.67) JAK1JAK2JAK3KCNH2
SCHEMBL24474748 0.86 JAK1 (0.67) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114269736-B Amide compound, pharmaceutical composition and application thereof 科辉智药(深圳)新药研究中心有限公司 2024-02-02 — — CN disclosed
EP-4253375-A1 AMIDE COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF Artivila (ShenZhen) Innovation Center, Ltd. (CN) 2023-10-04 — — EP disclosed
EP-3353168-B1 COMPOUNDS AND METHODS FOR INHIBITING JAK DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2023-08-30 — — EP disclosed
EP-4219482-A1 COMPOUNDS AND METHODS FOR INHIBITING JAK DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-08-02 — — EP disclosed
EP-4219482-A1 COMPOUNDS AND METHODS FOR INHIBITING JAK DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-08-02 — — EP disclosed
WO-2022111499-A1 AMIDE COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF 深圳铂立健医药有限公司 2022-06-02 — — WO disclosed
WO-2017050938-A1 COMPOUNDS AND METHODS FOR INHIBITING JAK ASTRAZENECA AB (SE) 2017-03-30 — — WO disclosed
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