SCHEMBL17907625

SCHEMBL17907625

O=C(O)CCCCC(=O)N1CCc2c(n(Cc3cccc(C(F)(F)F)c3)c3ncccc23)C1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 20/20 0.80

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
SCHEMBL17907690 0.90 ENPP2 (0.83) ENPP2
SCHEMBL14892076 0.89 ENPP2 (1.00) ENPP2
SCHEMBL17907706 0.88 ENPP2 (0.83) ENPP2
SCHEMBL14892578 0.88 ENPP2 (1.00) ENPP2
SCHEMBL14891572 0.87 ENPP2 (0.85) ENPP2
SCHEMBL14891065 0.87 ENPP2 (1.00) ENPP2
SCHEMBL14891174 0.87 ENPP2 (0.85) ENPP2
SCHEMBL14892206 0.86 ENPP2 (1.00) ENPP2
SCHEMBL14891641 0.86 ENPP2 (0.81) ENPP2
SCHEMBL14891591 0.85 ENPP2 (0.87) 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