SCHEMBL17907849

SCHEMBL17907849

O=C(O)c1ccc(CC(=O)N2CCc3c(n(Cc4ccc(C(F)(F)F)s4)c4ncccc34)C2)cc1Cl

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 20/20 0.65

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
SCHEMBL17907755 0.93 ENPP2 (0.67) ENPP2
SCHEMBL17907746 0.91 ENPP2 (0.69) ENPP2
SCHEMBL17907783 0.90 ENPP2 (0.74) ENPP2
SCHEMBL17907862 0.90 ENPP2 (0.68) ENPP2
SCHEMBL17907824 0.88 ENPP2 (0.70) ENPP2
SCHEMBL17907618 0.88 ENPP2 (0.67) ENPP2
SCHEMBL17907794 0.84 ENPP2 (0.66) ENPP2
SCHEMBL17907843 0.84 ENPP2 (0.75) ENPP2
SCHEMBL17907800 0.83 ENPP2 (0.70) ENPP2
SCHEMBL14892519 0.83 ENPP2 (0.79) 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