SCHEMBL19119359

SCHEMBL19119359

Cc1c(OC(=O)N(C)Cc2nsc(NC(=O)NCc3cccc(F)c3)n2)sc2nc[nH]c(=O)c12

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
ROCK2 O75116 2/20 0.38
ATG4B Q9Y4P1 1/20 0.38
ROCK1 Q13464 1/20 0.38
THRB P10828 2/20 0.38
LMNA P02545 1/20 0.37
NAMPT P43490 2/20 0.36
TP53 P04637 1/20 0.35
BCAT2 O15382 3/20 0.35
MAPK1 P28482 2/20 0.35
EPHX2 P34913 1/20 0.34
BLM P54132 1/20 0.34
CHRM4 P08173 1/20 0.34
AURKA O14965 1/20 0.34
CDK8 P49336 1/20 0.34
AURKB Q96GD4 1/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.33

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
SCHEMBL353718 0.88 MAPT (0.45) MAPTROCK2ATG4BROCK1THRB
SCHEMBL19119383 0.84 THRB (0.36) MAPTTHRBLMNATP53BCAT2
SCHEMBL19119534 0.78 ROCK2 (0.43) MAPTROCK2ATG4BROCK1LMNA
SCHEMBL19119260 0.78 ROCK2 (0.42) MAPTROCK2ATG4BROCK1NAMPT
SCHEMBL19119139 0.78 MAPK1 (0.44) MAPTROCK2ATG4BROCK1LMNA
SCHEMBL353549 0.77 MAPT (0.45) MAPTROCK2ATG4BROCK1THRB
SCHEMBL19119229 0.76 ROCK2 (0.42) ROCK2ATG4BROCK1NAMPTMAPK1
SCHEMBL19118725 0.76 ROCK2 (0.42) MAPTROCK2ATG4BROCK1LMNA
SCHEMBL19119544 0.76 ROCK2 (0.42) ROCK2ATG4BROCK1NAMPTMAPK1
SCHEMBL19118749 0.75 ROCK2 (0.42) MAPTROCK2ATG4BROCK1LMNA

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-2200440-B1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS CRESTONE INC (US) 2017-07-19 EP claimed