SCHEMBL12336269

SCHEMBL12336269

COSc1nc(N)cc(Oc2ccc(-c3nnc(Nc4cccc(C(F)(F)F)c4)[nH]3)cc2)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.61
KIT P10721 1/20 0.61
PDGFRA P16234 1/20 0.61
CDK11B P21127 1/20 0.61
FLT3 P36888 1/20 0.61
CDKL2 Q92772 1/20 0.61
KDR P35968 8/20 0.40
BRAF P15056 5/20 0.40
MAPK14 Q16539 4/20 0.40
TNNI3K Q59H18 4/20 0.40
APP P05067 1/20 0.39
HTT P42858 1/20 0.39
RAF1 P04049 1/20 0.38
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37
NTRK1 P04629 1/20 0.36
POLB P06746 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL625598 0.91 PDGFRB (0.73) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12336250 0.90 PDGFRB (0.61) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12348796 0.90 PDGFRB (0.61) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12348785 0.89 PDGFRB (0.60) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12336268 0.89 PDGFRB (0.60) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12336300 0.87 PDGFRB (0.55) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12336283 0.87 PDGFRB (0.56) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL627642 0.87 PDGFRB (0.56) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL12336416 0.86 PDGFRB (0.57) PDGFRBKITPDGFRACDK11BFLT3
SCHEMBL20125547 0.85 PDGFRB (0.56) PDGFRBKITPDGFRACDK11BFLT3

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
EP-2550266-B1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTICS SOLUTIONS INC (US) 2018-05-09 EP disclosed
WO-2011119894-A2 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION KINAGEN, INC (US) 2011-09-29 WO disclosed