SCHEMBL29883118

SCHEMBL29883118

CNC(=O)c1cnc(Nc2cn(C)nc2C)nc1Nc1cccc(-c2noc(C)n2)c1OC

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 14/20 0.45
▸ TYK2 P29597 12/20 0.45
▸ KCNH2 Q12809 3/20 0.44
▸ STAT3 P40763 1/20 0.41
▸ AXL P30530 1/20 0.41
▸ MERTK Q12866 1/20 0.41
▸ JAK2 O60674 3/20 0.40
▸ ULK1 O75385 1/20 0.40
▸ INSR P06213 1/20 0.39
▸ ALK Q9UM73 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ LRRK2 Q5S007 1/20 0.39

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
SCHEMBL29232093 1.00 JAK1 (0.45) JAK1TYK2KCNH2STAT3AXL
SCHEMBL29232107 0.82 AXL (0.51) JAK1TYK2KCNH2AXLMERTK
SCHEMBL29232010 0.82 TYK2 (0.41) JAK1TYK2KCNH2AXLMERTK
SCHEMBL31711644 0.80 TYK2 (0.49) JAK1TYK2KCNH2STAT3JAK2
SCHEMBL27417732 0.80 TYK2 (0.49) JAK1TYK2KCNH2STAT3JAK2
SCHEMBL31711632 0.79 TYK2 (0.49) JAK1TYK2KCNH2STAT3JAK2
SCHEMBL27414932 0.79 TYK2 (0.49) JAK1TYK2KCNH2STAT3JAK2
SCHEMBL29882997 0.79 TYK2 (0.43) JAK1TYK2KCNH2STAT3
SCHEMBL29232078 0.78 TYK2 (0.44) JAK1TYK2KCNH2STAT3LRRK2
SCHEMBL29882805 0.78 TYK2 (0.44) JAK1TYK2KCNH2STAT3LRRK2

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
CN-115197196-B TYK2 inhibitor and application thereof 扬子江药业集团有限公司 2024-06-18 — — CN disclosed
CN-115197196-A TYK2 inhibitor and application thereof 扬子江药业集团有限公司 2022-10-18 — — CN disclosed
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