SCHEMBL17907628

SCHEMBL17907628

CCc1cccc(Cn2c3c(c4cccnc42)CCN(C(=O)COCC(C)(C)C(=O)O)C3)c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 20/20 0.69

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
SCHEMBL17907655 0.92 ENPP2 (0.68) ENPP2
SCHEMBL14892222 0.91 ENPP2 (0.83) ENPP2
SCHEMBL17907735 0.90 ENPP2 (0.67) ENPP2
SCHEMBL14891090 0.88 ENPP2 (0.64) ENPP2
SCHEMBL14891992 0.88 ENPP2 (0.63) ENPP2
SCHEMBL14890906 0.88 ENPP2 (0.64) ENPP2
SCHEMBL17907752 0.87 ENPP2 (0.84) ENPP2
SCHEMBL14891127 0.87 ENPP2 (0.67) ENPP2
SCHEMBL14891612 0.87 ENPP2 (0.69) ENPP2
SCHEMBL14891433 0.86 ENPP2 (0.65) 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