SCHEMBL13479954

SCHEMBL13479954

O=C(O)CCCN1CCC(CNC(=O)c2cccc3c2OCCO3)CC1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 20/20 0.80

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
SCHEMBL17193155 0.89 HTR4 (1.00) HTR4
Hydrochloric Acid SCHEMBL2942576 0.88 HTR4 (0.98) HTR4
SCHEMBL13036124 0.87 HTR4 (0.78) HTR4
SCHEMBL4341194 0.84 HTR4 (0.75) HTR4
SCHEMBL13944343 0.83 HTR4 (0.83) HTR4
SCHEMBL7954585 0.82 HTR4 (1.00) HTR4
SCHEMBL7952718 0.82 HTR4 (1.00) HTR4
SCHEMBL7952197 0.82 HTR4 (1.00) HTR4
SCHEMBL7950961 0.81 HTR4 (1.00) HTR4
SCHEMBL7944045 0.81 HTR4 (1.00) HTR4

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-1701951-B1 MODULATORS OF PERIPHERAL 5-HT RECEPTORS SERODUS AS (NO) 2010-02-10 EP disclosed