SCHEMBL1287020

SCHEMBL1287020

O=C(O)c1ccnc(CN2CCCC2C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 10/20 0.54
▸ KDM5C P41229 4/20 0.54
▸ PROKR1 Q8TCW9 4/20 0.41
▸ GRM2 Q14416 1/20 0.40
▸ KDM2B Q8NHM5 4/20 0.38
▸ PIK3CA P42336 1/20 0.37
▸ KDM6B O15054 3/20 0.37
▸ KDM2A Q9Y2K7 3/20 0.37
▸ KDM3A Q9Y4C1 3/20 0.37
▸ KDM4A O75164 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ KDM5A P29375 1/20 0.37
▸ KDM5B Q9UGL1 1/20 0.37

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
SCHEMBL1287060 0.86 KDM4C (0.41) KDM4CKDM5CPROKR1GRM2KDM6B
SCHEMBL17144425 0.83 KDM4C (0.56) KDM4CKDM5CPROKR1KDM2BKDM6B
SCHEMBL17144627 0.83 KDM4C (0.56) KDM4CKDM5CPROKR1KDM2BKDM6B
SCHEMBL19741668 0.80 KDM4C (0.55) KDM4CKDM5CKDM2BKDM6BKDM2A
SCHEMBL17144210 0.78 KDM4C (0.59) KDM4CKDM5CKDM2BPIK3CAKDM6B
SCHEMBL19741723 0.77 KDM4C (0.49) KDM4CKDM5CPROKR1KDM6BKDM2A
SCHEMBL17144580 0.77 KDM4C (0.49) KDM4CKDM5CPROKR1KDM6BKDM2A
SCHEMBL17144601 0.77 KDM4C (0.49) KDM4CKDM5CPROKR1KDM6BKDM2A
SCHEMBL17144386 0.77 KDM4C (0.49) KDM4CKDM5CPROKR1KDM2BKDM6B
SCHEMBL2305288 0.74 KDM4C (0.76) KDM4CKDM5CKDM2BPIK3CAKDM6B

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-2012047156-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS PLASMINOGEN INHIBITORS AND THEIR USE IN THE TREATMENT OF FIBRINOLYSIS RELATED DISEASES ASTRAZENECA AB (SE) 2012-04-12 — — WO disclosed
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