SCHEMBL9727223

SCHEMBL9727223

Oc1cccc2c1CC(N1CCC1)CC2

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.71
CHRM3 P20309 2/20 0.51
CHRM2 P08172 1/20 0.50
CHRM1 P11229 1/20 0.50
HTR1D P28221 3/20 0.48
BCL2L1 Q07817 1/20 0.47
BAD Q92934 1/20 0.47
HTR1A P08908 3/20 0.47
DRD2 P14416 3/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
TSHR P16473 1/20 0.46
DRD3 P35462 1/20 0.46

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
SCHEMBL11072209 0.95 HTR7 (0.69) HTR7CHRM3CHRM2CHRM1HTR1D
SCHEMBL7932835 0.95 HTR7 (0.69) HTR7CHRM3CHRM2CHRM1HTR1D
Hydrochloric Acid SCHEMBL7926756 0.94 HTR7 (0.67) HTR7CHRM3CHRM2CHRM1HTR1D
SCHEMBL13533343 0.87 HTR7 (0.70) HTR7CHRM3CHRM2CHRM1HTR1D
SCHEMBL13533347 0.87 HTR7 (0.66) HTR7CHRM3CHRM2CHRM1HTR1D
SCHEMBL13533345 0.87 HTR7 (0.66) HTR7CHRM3CHRM2CHRM1HTR1D
SCHEMBL13533346 0.87 HTR7 (0.70) HTR7CHRM3CHRM2CHRM1HTR1D
SCHEMBL9727380 0.81 HTR7 (0.60) HTR7HTR1DHTR1ADRD2DRD3
SCHEMBL10554244 0.81 HTR7 (0.70) HTR7CHRM3CHRM2CHRM1HTR1D
Hydrochloric Acid SCHEMBL7935442 0.80 HTR7 (0.57) HTR7CHRM3CHRM2CHRM1HTR1D

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-5164385-A AZETIDINE DERIVATIVES AND HYPOTENSIVE COMPOSITIONS THEREOF JOHN WYETH & BROTHER, LTD. (GB) 1992-11-17 US claimed
US-5164385-A AZETIDINE DERIVATIVES AND HYPOTENSIVE COMPOSITIONS THEREOF JOHN WYETH & BROTHER, LTD. (GB) 1992-11-17 US disclosed