SCHEMBL9304347

SCHEMBL9304347

CCCN(CCCCN1C(=O)CC2(CCCCC2)C1=O)C1COCc2c(O)cccc21

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.43
HTR1A P08908 2/20 0.43
DRD1 P21728 2/20 0.43
HTR1B P28222 2/20 0.43
HTR2A P28223 2/20 0.43
DRD3 P35462 1/20 0.41

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
SCHEMBL9304965 0.89 HTR1A (0.54) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9305738 0.82 HTR1A (0.47) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9304340 0.81 HTR1A (0.64) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9304956 0.72 HTR1A (0.81) DRD2HTR1ADRD1HTR1BHTR2A
Oxalic Acid SCHEMBL9304567 0.70 HTR1A (0.75) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9305474 0.69 HTR1A (0.47) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9305493 0.68 HTR1A (0.58) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9305392 0.68 HTR1A (0.47) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9305727 0.65 HTR1A (0.71) DRD2HTR1ADRD1HTR1BHTR2A
SCHEMBL9304624 0.64 HTR1A (0.41) DRD2HTR1ADRD1HTR1BHTR2A

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-5346916-A FOR TREATING ANIMALS SUFFERING FROM DISORDERS OF THE SEROTONINERGIC SYSTEM ADIR ET COMPAGNIE (FR) 1994-09-13 US disclosed
US-5273994-A Also hydroxy- or alkyl ether-substituted ADIR ET COMPAGNIE (FR) 1993-12-28 US disclosed