SCHEMBL14103244

SCHEMBL14103244

CCCCCCCCCCCC(=O)N[C@@H](C(=O)N[C@@H](CCC(=O)NCc1ccncc1)C(=O)NCc1ccncc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.53
▸ NPY1R P25929 1/20 0.49
▸ GAA P10253 1/20 0.48
▸ GPR88 Q9GZN0 1/20 0.48
▸ FAAH O00519 2/20 0.47
▸ CNR1 P21554 1/20 0.46
▸ CNR2 P34972 1/20 0.46

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
SCHEMBL14102843 0.89 GAA (0.57) EPHX2GAAGPR88
SCHEMBL14102830 0.87 EPHX2 (0.57) EPHX2GAAFAAHCNR1CNR2
SCHEMBL14102643 0.87 EPHX2 (0.57) EPHX2GAAFAAHCNR1CNR2
SCHEMBL14102828 0.87 EPHX2 (0.57) EPHX2GAAFAAHCNR1CNR2
SCHEMBL14102594 0.87 EPHX2 (0.57) EPHX2GAAFAAHCNR1CNR2
SCHEMBL14102770 0.87 EPHX2 (0.57) EPHX2GAAFAAHCNR1CNR2
SCHEMBL14102630 0.87 EPHX2 (0.57) EPHX2GAAFAAHCNR1CNR2
SCHEMBL14102591 0.87 EPHX2 (0.57) EPHX2GAAFAAHCNR1CNR2
SCHEMBL14103242 0.83 LMNA (0.47) EPHX2NPY1RFAAH
SCHEMBL14102592 0.78 EPHX2 (0.59) EPHX2FAAHCNR1CNR2

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-2008102127-A2 GEL FORMING COMPOUNDS PLIVA HRVATSKA D.O.O. (HR) 2008-08-28 — — WO disclosed
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