SCHEMBL17907678

SCHEMBL17907678

Cn1nc(-c2ccccc2)cc1Cn1c2c(c3cccnc31)CCN(C(=O)CCCC(C)(C)C(=O)O)C2

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 20/20 0.67

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
SCHEMBL14891779 0.90 ENPP2 (0.70) ENPP2
SCHEMBL17907744 0.89 ENPP2 (0.63) ENPP2
SCHEMBL17907760 0.89 ENPP2 (0.70) ENPP2
SCHEMBL14891019 0.86 ENPP2 (0.73) ENPP2
SCHEMBL14891516 0.85 ENPP2 (0.83) ENPP2
SCHEMBL14891312 0.83 ENPP2 (0.68) ENPP2
SCHEMBL17907726 0.82 ENPP2 (0.69) ENPP2
SCHEMBL14892032 0.82 ENPP2 (0.59) ENPP2
SCHEMBL14892219 0.82 ENPP2 (0.79) ENPP2
SCHEMBL14891068 0.82 ENPP2 (0.78) 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