SCHEMBL9790073

SCHEMBL9790073

CCOC(=O)N1CC[C@@H](NC(=O)c2cc(N)c(Cl)cc2OC)[C@@H](OC)C1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 20/20 0.76
KCNH2 Q12809 7/20 0.76

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
SCHEMBL9790079 1.00 HTR4 (0.76) HTR4KCNH2
SCHEMBL9790086 1.00 HTR4 (0.76) HTR4KCNH2
SCHEMBL6843940 0.96 HTR4 (0.81) HTR4KCNH2
SCHEMBL9021743 0.96 HTR4 (0.81) HTR4KCNH2
SCHEMBL6843942 0.96 HTR4 (0.81) HTR4KCNH2
SCHEMBL9531399 0.89 HTR4 (0.65) HTR4KCNH2
SCHEMBL9531252 0.89 HTR4 (0.65) HTR4KCNH2
SCHEMBL9531408 0.89 HTR4 (0.65) HTR4KCNH2
SCHEMBL3317348 0.86 HTR4 (1.00) HTR4KCNH2
SCHEMBL3317350 0.86 HTR4 (1.00) 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
US-4990521-A Treating diarhea JANSSEN PHARMACEUTICA (BE) 1991-02-05 US disclosed
EP-0251417-A2 4-(aroylamino) piperidinebutanamide derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1988-01-07 EP disclosed