SCHEMBL30227459

SCHEMBL30227459

O=C(O)N1C2CCC1CC(Nc1nc(Cl)cc3nccn13)C2

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SUV39H2 Q9H5I1 3/20 0.33
▸ CHRM4 P08173 1/20 0.32
▸ KMT2A Q03164 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ MAPK8 P45983 2/20 0.31
▸ HTR3A P46098 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ ATAD2 Q6PL18 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ MGLL Q99685 1/20 0.31
▸ JAK2 O60674 1/20 0.30
▸ JAK1 P23458 1/20 0.30
▸ TYK2 P29597 1/20 0.30
▸ JAK3 P52333 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ LTA4H P09960 1/20 0.30

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
SCHEMBL22054131 0.85 SUV39H2 (0.47) SUV39H2
SCHEMBL23889390 0.85 SUV39H2 (0.47) SUV39H2
SCHEMBL23889532 0.75 EIF2AK4 (0.41) SUV39H2KMT2AJAK2JAK1JAK3
SCHEMBL30227542 0.72 JAK2 (0.36) SUV39H2BRD4ATAD2JAK2JAK1
SCHEMBL25355686 0.72 TYK2 (0.51) JAK2JAK1TYK2JAK3
SCHEMBL23878826 0.72 TYK2 (0.51) JAK2JAK1TYK2JAK3
SCHEMBL18260558 0.72 TYK2 (0.51) JAK2JAK1TYK2JAK3
SCHEMBL18260559 0.72 TYK2 (0.51) JAK2JAK1TYK2JAK3
SCHEMBL30504363 0.72 TYK2 (0.51) JAK2JAK1TYK2JAK3
SCHEMBL18260492 0.68 JAK3 (0.51) JAK2JAK1TYK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116003441-B Heteroaromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2025-06-10 — — CN disclosed
CN-115925705-B Heteroaromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2024-12-31 — — CN disclosed
CN-116003441-A Heteroaromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2023-04-25 — — CN disclosed
CN-115925705-A Heteroaromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2023-04-07 — — CN disclosed
CN-111511738-B Heteroaromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2023-01-20 — — CN disclosed
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