SCHEMBL26078109

SCHEMBL26078109

COc1nn(C)cc1Nc1ncc(F)c(-c2c[nH]c3c(NC=O)cccc23)n1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 18/20 0.67
▸ JAK2 O60674 15/20 0.67
▸ JAK3 P52333 1/20 0.56
▸ KCNH2 Q12809 1/20 0.56

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
SCHEMBL26078108 0.92 JAK1 (0.70) JAK1JAK2JAK3KCNH2
SCHEMBL24474969 0.90 JAK1 (0.68) JAK1JAK2JAK3KCNH2
SCHEMBL24474769 0.88 JAK1 (0.66) JAK1JAK2
SCHEMBL24474853 0.87 JAK1 (0.65) JAK1JAK2JAK3KCNH2
SCHEMBL25369910 0.86 JAK1 (0.64) JAK1JAK2JAK3KCNH2
SCHEMBL25407580 0.85 JAK1 (0.74) JAK1JAK2
SCHEMBL25370003 0.84 JAK1 (0.79) JAK1JAK2JAK3KCNH2
SCHEMBL25370006 0.84 JAK1 (0.79) JAK1JAK2JAK3KCNH2
SCHEMBL25407572 0.83 JAK1 (0.69) JAK1JAK2JAK3KCNH2
SCHEMBL25407562 0.82 JAK1 (0.64) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4253375-A1 AMIDE COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF Artivila (ShenZhen) Innovation Center, Ltd. (CN) 2023-10-04 — — EP disclosed
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