SCHEMBL17907633

SCHEMBL17907633

CC(C)(CCCC(=O)N1CCc2c(n(Cc3ccc(F)c(C(F)(F)F)c3)c3ncccc23)C1)C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 20/20 0.78

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
SCHEMBL17907826 0.94 ENPP2 (0.78) ENPP2
SCHEMBL17907605 0.93 ENPP2 (0.76) ENPP2
SCHEMBL14892517 0.93 ENPP2 (0.83) ENPP2
SCHEMBL17907742 0.92 ENPP2 (0.75) ENPP2
SCHEMBL14890819 0.91 ENPP2 (0.81) ENPP2
SCHEMBL14891976 0.90 ENPP2 (0.80) ENPP2
SCHEMBL14891021 0.90 ENPP2 (0.81) ENPP2
SCHEMBL17907632 0.89 ENPP2 (0.75) ENPP2
SCHEMBL14891765 0.89 ENPP2 (0.77) ENPP2
SCHEMBL14890781 0.89 ENPP2 (0.80) 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