SCHEMBL27387022

SCHEMBL27387022

CN1CCN(Cc2ccc(Nc3nc(-c4ccc(C(=O)NCC#N)cc4)c4cc[nH]c4n3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 11/20 0.57
▸ JAK3 P52333 11/20 0.57
▸ AXL P30530 5/20 0.48
▸ LRRK2 Q5S007 2/20 0.48
▸ MERTK Q12866 5/20 0.47
▸ TTK P33981 1/20 0.46
▸ JAK1 P23458 4/20 0.46
▸ CHEK1 O14757 1/20 0.45
▸ AURKA O14965 1/20 0.45
▸ DAPK3 O43293 1/20 0.45
▸ MAP4K4 O95819 1/20 0.45
▸ PAK4 O96013 1/20 0.45
▸ RET P07949 1/20 0.45
▸ LTK P29376 1/20 0.45
▸ KDR P35968 1/20 0.45
▸ MAP2K2 P36507 1/20 0.45
▸ MAPK8 P45983 1/20 0.45
▸ MAPK9 P45984 1/20 0.45
▸ CSNK1A1 P48729 1/20 0.45
▸ CLK2 P49760 1/20 0.45

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
SCHEMBL30788193 1.00 JAK2 (0.57) JAK2JAK3AXLLRRK2MERTK
SCHEMBL30788187 0.88 LRRK2 (0.51) JAK2JAK3AXLLRRK2MERTK
SCHEMBL30788205 0.86 LRRK2 (0.52) JAK2JAK3LRRK2TTKCHEK1
SCHEMBL27387131 0.83 AXL (0.70) JAK2JAK3AXLJAK1KDR
SCHEMBL30788192 0.82 JAK2 (0.70) JAK2JAK3TTKJAK1MAPK8
SCHEMBL30788214 0.80 JAK1 (0.47) JAK2JAK3LRRK2JAK1PTK2
SCHEMBL27387027 0.80 JAK1 (0.47) JAK2JAK3LRRK2JAK1PTK2
SCHEMBL30788218 0.75 JAK1 (0.48) JAK2JAK3LRRK2TTKJAK1
SCHEMBL34463174 0.75 LRRK2 (0.51) LRRK2TTKPTK2
SCHEMBL30788200 0.75 JAK1 (0.46) JAK2JAK3LRRK2JAK1CHEK1

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
WO-2024035771-A2 ULK3 INHIBITORS AND USES THEREOF H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2024-02-15 — — WO disclosed
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