SCHEMBL25776992

SCHEMBL25776992

CCC(CC)NC(=O)c1cc(-c2cnn3cc(Nc4cnn(C)c4)cnc23)cs1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MARK3 P27448 17/20 0.61
SGK1 O00141 2/20 0.55
PIK3CD O00329 2/20 0.55
CHEK1 O14757 2/20 0.55
MAPK13 O15264 2/20 0.55
PDPK1 O15530 2/20 0.55
NUAK1 O60285 2/20 0.55
CCNT1 O60563 2/20 0.55
JAK2 O60674 2/20 0.55
ROCK2 O75116 2/20 0.55
CHEK2 O96017 2/20 0.55
EGFR P00533 2/20 0.55
RAF1 P04049 2/20 0.55
NTRK1 P04629 2/20 0.55
LCK P06239 2/20 0.55
CSF1R P07333 2/20 0.55
MET P08581 2/20 0.55
HCK P08631 2/20 0.55
KIT P10721 2/20 0.55
PIM1 P11309 2/20 0.55

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
SCHEMBL25423731 0.89 MARK3 (0.51) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL3758667 0.88 MARK3 (0.78) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25425744 0.86 MARK3 (0.56) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25776990 0.83 ULK1 (0.72) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25777056 0.83 MARK3 (0.56) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25426610 0.82 MARK3 (0.49) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25424662 0.81 MARK3 (0.54) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25776980 0.80 MARK3 (0.62) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25776979 0.80 MARK3 (0.50) MARK3SGK1PIK3CDCHEK1MAPK13
SCHEMBL25776841 0.79 MARK3 (0.52) MARK3SGK1PIK3CDCHEK1MAPK13

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-2023122756-A2 ULK1 AND ULK2 INHIBITORS BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-06-29 WO disclosed