SCHEMBL8089999

SCHEMBL8089999

CSc1ccc2c(SCc3ccc(N4CCOCC4)cc3)ccnc2c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.39
PRKDC P78527 10/20 0.39
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
MAPKAPK2 P49137 1/20 0.37
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PCSK9 Q8NBP7 1/20 0.36
PLK4 O00444 1/20 0.36
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
RAC1 P63000 1/20 0.35
MET P08581 1/20 0.35

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
SCHEMBL8088244 0.91 MAPKAPK2 (0.38) PRKDCMAPKAPK2ALDH1A1CCNCCDK8
SCHEMBL8084113 0.90 MAPKAPK2 (0.38) PRKDCMAPKAPK2ALDH1A1NPSR1CCNC
SCHEMBL8089831 0.89 MAPKAPK2 (0.48) MAPKAPK2CCNCCDK8
SCHEMBL8088300 0.86 MAPKAPK2 (0.37) MAPKAPK2
SCHEMBL8084133 0.85 HTR7 (0.37) MAPKAPK2ALDH1A1NPSR1
SCHEMBL8084787 0.79 KMT2A (0.39) ALDH1A1
SCHEMBL8076742 0.78 QPCT (0.41) ALDH1A1MAPK1
SCHEMBL8089824 0.76 PRNP (0.34) ALDH1A1MAPTMAPK1
SCHEMBL8084411 0.76 KMT2A (0.37) MAPKAPK2TP53MAPT
SCHEMBL8084729 0.76 SMN1; SMN2 (0.40) ALDH1A1MAPTMAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6057447-A BACTERICIDES FOR CAMPYLOBACTER ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2000-05-02 US disclosed
EP-0926139-A1 QUINOLINE SULFIDE DERIVATIVES ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1999-06-30 EP disclosed