SCHEMBL17907828

SCHEMBL17907828

CC(C)(CCCC(=O)N1CCc2c(n(Cc3cccc(C(F)(F)F)c3F)c3ncccc23)C1)C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 20/20 0.74

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
SCHEMBL14891563 0.92 ENPP2 (0.79) ENPP2
SCHEMBL14892400 0.91 ENPP2 (0.76) ENPP2
SCHEMBL14892556 0.90 ENPP2 (0.75) ENPP2
SCHEMBL17907647 0.89 ENPP2 (0.73) ENPP2
SCHEMBL14891369 0.89 ENPP2 (0.75) ENPP2
SCHEMBL14890863 0.89 ENPP2 (0.82) ENPP2
SCHEMBL14891068 0.88 ENPP2 (0.78) ENPP2
SCHEMBL14891400 0.87 ENPP2 (0.82) ENPP2
SCHEMBL14891991 0.87 ENPP2 (0.78) ENPP2
SCHEMBL14891633 0.86 ENPP2 (0.85) 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
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