SCHEMBL6427982

SCHEMBL6427982

Cn1sc(=O)n(-c2cccc(Oc3ccccc3)c2)c1=O

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 12/20 0.69
GSK3B P49841 12/20 0.69
NTRK1 P04629 5/20 0.48
IGF1R P08069 5/20 0.48
FGFR1 P11362 5/20 0.48
NTRK2 Q16620 5/20 0.48
NTRK3 Q16288 1/20 0.43
MGLL Q99685 1/20 0.42
CCNB2 O95067 1/20 0.41
CDK1 P06493 1/20 0.41
CCNB1 P14635 1/20 0.41
CCNB3 Q8WWL7 1/20 0.41

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
SCHEMBL6427365 0.88 GSK3A (0.73) GSK3AGSK3BNTRK1IGF1RFGFR1
SCHEMBL3384007 0.82 GSK3B (1.00) GSK3AGSK3BCCNB2CDK1CCNB1
SCHEMBL3384147 0.70 GSK3A (1.00) GSK3AGSK3BMGLL
SCHEMBL3382637 0.67 GSK3A (1.00) GSK3AGSK3BMGLL
SCHEMBL4263923 0.66 MGLL (0.73) MGLL
SCHEMBL3384854 0.66 GSK3A (1.00) GSK3AGSK3BMGLLCCNB2CDK1
SCHEMBL28477376 0.66 KDM4E (0.61) NTRK1IGF1RFGFR1NTRK2NTRK3
SCHEMBL21295403 0.65 NTRK1 (1.00) NTRK1IGF1RFGFR1NTRK2NTRK3
SCHEMBL27863634 0.65 MGLL (0.71) MGLL
SCHEMBL27863609 0.65 MGLL (0.71) MGLL

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-2005024755-A2 MEDICAMENTS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS OR DIABETES DECIPHERA PHARMACEUTICALS, LLC. (US) 2005-03-17 WO disclosed