SCHEMBL7941591

SCHEMBL7941591

C=CCN1CCCCC1C1CNC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 15/20 0.38
DRD2 P14416 4/20 0.38
PRCP P42785 1/20 0.38
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CHRM2 P08172 1/20 0.36
ACHE P22303 1/20 0.36
PTGS1 P23219 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
OPRK1 P41145 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL4783519 0.89 HTR1A (0.35) HTR1ADRD2PRCPALDH1A1LMNA
SCHEMBL7986246 0.82 PRCP (0.44) HTR1ADRD2PRCPALDH1A1LMNA
SCHEMBL28236427 0.80 PRCP (0.43) HTR1ADRD2PRCP
SCHEMBL31247515 0.78 HTR1A (0.48) HTR1ADRD2PRCP
SCHEMBL5580304 0.77 HTR1A (0.44) HTR1ADRD2PRCP
SCHEMBL8520734 0.70 PRCP (0.36) HTR1ADRD2PRCPALDH1A1LMNA
SCHEMBL24033332 0.69 NPY1R (0.46) DRD2HTTDRD3
SCHEMBL3801626 0.68 PRCP (0.36) HTR1APRCP
SCHEMBL3264741 0.68 ALDH1A1 (0.42) ALDH1A1
SCHEMBL2844780 0.68 PRCP (0.36) HTR1ADRD2PRCP

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
US-6242438-B1 3-Azetidinylalkylpiperidines or -pyrrolidines as tachykinin antagonists PFIZER INC. 2001-06-05 US disclosed