SCHEMBL2660865

SCHEMBL2660865

Nc1nn(CCCNC(=O)O)c2ccc(C(F)(F)F)cc12

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 2/20 0.39
SCN9A Q15858 2/20 0.39
QPCT Q16769 2/20 0.37
ASAH1 Q13510 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PDE4A P27815 4/20 0.36
PDE4B Q07343 4/20 0.36
PDE4C Q08493 4/20 0.36
PDE4D Q08499 4/20 0.36
CCR3 P51677 1/20 0.36
TBK1 Q9UHD2 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
SRC P12931 1/20 0.35
PTGER4 P35408 1/20 0.35

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
SCHEMBL2662422 0.97 CNR1 (0.39) SCN5ASCN9AQPCTASAH1KDM4E
SCHEMBL14380104 0.85 BRD4 (0.42) CNR2
SCHEMBL2661076 0.83 KDM4C (0.38) ASAH1SRC
SCHEMBL5582964 0.80 KDM4C (0.37) ASAH1CNR1CNR2SRC
SCHEMBL2660965 0.79 SCN9A (0.41) SCN5ASCN9ATBK1
SCHEMBL2660425 0.77 CCR2 (0.44) SCN5ASCN9A
SCHEMBL2660265 0.74 CCR2 (0.43) SCN5ASCN9A
SCHEMBL11750074 0.74 ASAH1 (0.47) ASAH1PDE4APDE4BPDE4CPDE4D
SCHEMBL5583119 0.73 CCR2 (0.39) PDE4APDE4BPDE4CPDE4D
SCHEMBL14380101 0.72 CNR1 (0.47) CNR1CNR2PTGER4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966152-A2 GLUCOKINASE ACTIVATORS Takeda Pharmaceutical Company Limited (JP) 2008-09-10 EP disclosed
US-20070244169-A1 GLUCOKINASE ACTIVATORS TAKEDA SAN DIEGO, INC. 2007-10-18 US disclosed
WO-2007075847-A2 GLUCOKINASE ACTIVATORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-07-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070244169-A1 GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 SCN5A 2766/4885SCN9A 3230/4885QPCT 771/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.