SCHEMBL31663349

SCHEMBL31663349

COc1ccc2ncc(NCc3ccc4cc[nH]c4c3)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.49
PDGFRB P09619 3/20 0.47
PDGFRA P16234 3/20 0.47
ABL1 P00519 2/20 0.46
HPGDS O60760 1/20 0.44
MAPT P10636 2/20 0.41
APP P05067 1/20 0.41
CSF1R P07333 1/20 0.41
KIT P10721 1/20 0.41
MET P08581 1/20 0.41
TP53 P04637 2/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CLK4 Q9HAZ1 3/20 0.40
SYK P43405 1/20 0.39
DYRK1A Q13627 1/20 0.38
PTGDR Q13258 1/20 0.38

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
SCHEMBL31663283 0.85 ABL1 (0.44) MEN1KMT2APOLBPDGFRBPDGFRA
SCHEMBL31662945 0.85 ABL1 (0.46) PDGFRBPDGFRAABL1APPMET
SCHEMBL31663280 0.83 AHR (0.46) MEN1KMT2APDGFRBPDGFRAABL1
SCHEMBL31663182 0.83 PDE10A (0.46) POLBPDGFRBPDGFRAABL1APP
SCHEMBL31662867 0.83 MET (0.47) MEN1KMT2APDGFRBPDGFRAABL1
SCHEMBL31663355 0.81 ABL1 (0.44) MEN1KMT2APOLBPDGFRBPDGFRA
SCHEMBL31663339 0.80 MET (0.53) PDGFRBPDGFRAABL1METESR1
SCHEMBL31663079 0.80 CCNT1 (0.40) MAPK1PDGFRBPDGFRAABL1APP
SCHEMBL31662873 0.79 ABL1 (0.43) MEN1KMT2APOLBMAPK1PDGFRB
SCHEMBL31663077 0.78 MET (0.47) MAPK1PDGFRBPDGFRAABL1MAPT

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
WO-2025149622-A1 WNK1 INHIBITORS DANIA THERAPEUTICS APS (DK) 2025-07-17 WO claimed
WO-2025149622-A1 WNK1 INHIBITORS DANIA THERAPEUTICS APS (DK) 2025-07-17 WO disclosed