SCHEMBL26953246

SCHEMBL26953246

NCc1ccc(-c2ccnc3[nH]cc(-c4ccccc4F)c23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 1/20 0.46
LRRK2 Q5S007 10/20 0.45
STK3 Q13188 2/20 0.45
STK4 Q13043 1/20 0.45
JAK2 O60674 7/20 0.44
JAK3 P52333 1/20 0.41
CDC7 O00311 1/20 0.39
PLK4 O00444 1/20 0.39
CHEK1 O14757 1/20 0.39
MAPK13 O15264 1/20 0.39
PDPK1 O15530 1/20 0.39
DAPK3 O43293 1/20 0.39
DYRK3 O43781 1/20 0.39
ROCK2 O75116 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 1/20 0.39
ABL1 P00519 1/20 0.39
PRKCG P05129 1/20 0.39
CDK1 P06493 1/20 0.39
ROS1 P08922 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
SCHEMBL31734920 1.00 SGK1 (0.46) SGK1LRRK2STK3STK4JAK2
SCHEMBL31735009 0.86 LRRK2 (0.52) SGK1LRRK2STK3STK4JAK2
SCHEMBL26953146 0.86 LRRK2 (0.52) SGK1LRRK2STK3STK4JAK2
SCHEMBL31735012 0.86 SGK1 (0.57) SGK1LRRK2STK3STK4JAK2
SCHEMBL26953278 0.86 SGK1 (0.57) SGK1LRRK2STK3STK4JAK2
SCHEMBL26953435 0.86 SGK1 (0.44) SGK1LRRK2STK3JAK2CDC7
SCHEMBL31734984 0.86 SGK1 (0.44) SGK1LRRK2STK3JAK2CDC7
SCHEMBL31735137 0.85 LRRK2 (0.45) SGK1LRRK2STK3STK4JAK2
SCHEMBL26953219 0.85 LRRK2 (0.45) SGK1LRRK2STK3STK4JAK2
SCHEMBL31735066 0.82 JAK3 (0.55) SGK1LRRK2STK3STK4JAK2

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-2023239727-A1 LATS INHIBITORS AND USES THEREOF THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2023-12-14 WO disclosed