SCHEMBL17907807

SCHEMBL17907807

CC(C)(CCCC(=O)N1CCc2c(n(Cc3cc(Cl)cc(OC(F)(F)F)c3)c3ncccc23)C1)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 20/20 0.70

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
SCHEMBL17907808 0.91 ENPP2 (0.73) ENPP2
SCHEMBL14890857 0.91 ENPP2 (0.78) ENPP2
SCHEMBL17907626 0.91 ENPP2 (0.80) ENPP2
SCHEMBL17907750 0.89 ENPP2 (0.73) ENPP2
SCHEMBL14892062 0.89 ENPP2 (0.82) ENPP2
SCHEMBL17907833 0.88 ENPP2 (0.72) ENPP2
SCHEMBL17907766 0.88 ENPP2 (0.72) ENPP2
SCHEMBL14892409 0.87 ENPP2 (0.83) ENPP2
SCHEMBL14891849 0.87 ENPP2 (0.77) ENPP2
SCHEMBL17907632 0.87 ENPP2 (0.75) 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