SCHEMBL847028

SCHEMBL847028

O=C(Nc1cnc2ccccc2c1N1CCCCC1)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BCHE P06276 9/20 0.72

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
SCHEMBL847712 1.00 BCHE (0.72) BCHE
SCHEMBL15883613 0.85 BCHE (0.54) BCHE
SCHEMBL30155590 0.84 BCHE (1.00) BCHE
SCHEMBL28582718 0.84 BCHE (1.00) BCHE
SCHEMBL846605 0.82 BCHE (0.71) BCHE
SCHEMBL20368692 0.81 BCHE (0.50) BCHE
SCHEMBL21158406 0.81 BCHE (0.50) BCHE
SCHEMBL18399575 0.81 BCHE (0.50) BCHE
SCHEMBL846056 0.79 BCHE (0.52) BCHE
SCHEMBL30155672 0.79 BCHE (1.00) BCHE

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-1603883-B1 QUINOLINE-DERIVED AMIDE MODULATORS OF VANILLOID VR1 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-03-28 EP disclosed