SCHEMBL23889558

SCHEMBL23889558

Cc1cc(Nc2nc(NC3CC4CC[C@@H](C3)N4C(=O)OC(C)(C)C)nc3cnccc23)n[nH]1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.50
▸ TYK2 P29597 15/20 0.48
▸ JAK3 P52333 15/20 0.48
▸ JAK2 O60674 12/20 0.48
▸ JAK1 P23458 12/20 0.48
▸ AURKA O14965 1/20 0.42
▸ SRC P12931 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ PLK4 O00444 2/20 0.42
▸ PAK4 O96013 2/20 0.42

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
SCHEMBL22054196 1.00 GPR119 (0.50) GPR119TYK2JAK3JAK2JAK1
SCHEMBL23878810 1.00 GPR119 (0.50) GPR119TYK2JAK3JAK2JAK1
SCHEMBL30147209 0.90 AURKA (0.53) GPR119TYK2JAK3JAK2JAK1
SCHEMBL22054065 0.90 AURKA (0.53) GPR119TYK2JAK3JAK2JAK1
SCHEMBL30147210 0.89 GPR119 (0.47) GPR119TYK2JAK3JAK2JAK1
SCHEMBL22055044 0.89 GPR119 (0.47) GPR119TYK2JAK3JAK2JAK1
SCHEMBL22054573 0.88 GPR119 (0.53) GPR119TYK2JAK3JAK2JAK1
SCHEMBL22054197 0.88 GPR119 (0.52) GPR119TYK2JAK3JAK2JAK1
SCHEMBL30147224 0.88 GPR119 (0.52) GPR119TYK2JAK3JAK2JAK1
SCHEMBL30147229 0.88 GPR119 (0.53) GPR119TYK2JAK3JAK2JAK1

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-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 — — EP disclosed
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