SCHEMBL4069102

SCHEMBL4069102

Cc1cc(Nc2ccccc2)nc2cc(C3=NC(C4CC(O)C4)=C4C=NC=C[N+]34N)c(F)cc12

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
F2 P00734 2/20 0.33
PLG P00747 1/20 0.33
PRSS1 P07477 1/20 0.33
POLB P06746 1/20 0.32
MAPT P10636 6/20 0.31
KDM4E B2RXH2 2/20 0.31
RAB9A P51151 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL4063671 0.88
SCHEMBL4073430 0.87
SCHEMBL4072523 0.85 KDM4E (0.38) F2PLGPRSS1KDM4ELMNA
SCHEMBL4067705 0.83
SCHEMBL399466 0.78 PIM1 (0.32)
SCHEMBL402077 0.78
SCHEMBL400475 0.76 F2 (0.36) MEN1KMT2AF2PLGPRSS1
SCHEMBL400116 0.75 F2 (0.39) MEN1KMT2AF2PLGPRSS1
SCHEMBL399525 0.74 F2 (0.34) MEN1KMT2AF2PLGPRSS1
SCHEMBL402031 0.74 IGF1R (0.33)

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
EP-1740591-B1 6,6-BICYCLIC RING SUBSTITUTED HETEROBICYCLIC PROTEIN KINASE INHIBITORS OSI PHARM INC (US) 2009-06-17 EP claimed