SCHEMBL17907722

SCHEMBL17907722

O=C(O)Cc1cccc(OCC(=O)N2CCc3c(n(Cc4cccc(OC(F)(F)F)c4)c4ncccc34)C2)c1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 20/20 0.62

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
SCHEMBL17907735 0.87 ENPP2 (0.67) ENPP2
SCHEMBL17907747 0.86 ENPP2 (0.64) ENPP2
SCHEMBL17907857 0.85 ENPP2 (0.74) ENPP2
SCHEMBL17907801 0.84 ENPP2 (0.66) ENPP2
SCHEMBL17907860 0.84 ENPP2 (0.78) ENPP2
SCHEMBL17907790 0.84 ENPP2 (0.88) ENPP2
SCHEMBL17907751 0.83 ENPP2 (0.74) ENPP2
SCHEMBL15418232 0.83 ENPP2 (0.85) ENPP2
SCHEMBL17907626 0.83 ENPP2 (0.80) ENPP2
Bicarbonate SCHEMBL17907713 0.82 ENPP2 (0.66) ENPP2

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-2687531-B1 TETRAHYDROCARBOLINE DERIVATIVE ONO PHARMACEUTICAL CO (JP) 2016-07-13 EP claimed