SCHEMBL8054851

SCHEMBL8054851

CCN1CCC(NC(=O)c2cc(Cl)c(N)cc2OC)C(OC)C1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 19/20 0.77
KCNH2 Q12809 5/20 0.75

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
Water SCHEMBL9721598 0.99 HTR4 (0.76) HTR4KCNH2
Water SCHEMBL9721589 0.99 HTR4 (0.76) HTR4KCNH2
Water SCHEMBL9721584 0.99 HTR4 (0.76) HTR4KCNH2
SCHEMBL9728694 0.90 HTR4 (0.80) HTR4KCNH2
SCHEMBL9728308 0.90 HTR4 (0.80) HTR4KCNH2
SCHEMBL9022017 0.90 HTR4 (0.75) HTR4KCNH2
SCHEMBL9728381 0.90 HTR4 (0.80) HTR4KCNH2
SCHEMBL9728705 0.90 HTR4 (0.80) HTR4KCNH2
SCHEMBL1905248 0.90 HTR4 (0.75) HTR4KCNH2
SCHEMBL9021506 0.90 HTR4 (0.75) HTR4KCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1000029-A1 (+)-NORCISAPRIDE USEFUL FOR 5-HT3 AND 5-HT4 MEDIATED DISORDERS JANSSEN PHARMACEUTICA N.V. (BE) 2000-05-17 EP disclosed
WO-1999002496-A1 (+)-NORCISAPRIDE USEFUL FOR 5-HT3 AND 5-HT4 MEDIATED DISORDERS JANSSEN PHARMACEUTICA N.V. (BE) 1999-01-21 WO disclosed