SCHEMBL6965205

SCHEMBL6965205

Cn1ccc2c(OC3CCNC3)cccc21

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 9/20 0.49
SLC6A2 P23975 9/20 0.49
RHEB Q15382 1/20 0.46
HTR2C P28335 8/20 0.44
HTR2B P41595 8/20 0.44
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
PIM1 P11309 2/20 0.41
PIM2 Q9P1W9 2/20 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
SCHEMBL23709615 0.92 RHEB (0.48) HTR1ASLC6A2RHEBSLC6A4SLC6A3
SCHEMBL6493863 0.76 HTR6 (0.58)
Hydrochloric Acid SCHEMBL6504505 0.75 HTR6 (0.57)
SCHEMBL6956528 0.74 SLC6A2 (0.56) HTR1ASLC6A2HTR2CHTR2BSLC6A4
Hydrochloric Acid SCHEMBL6528932 0.74 HTR6 (0.47) HTR1ASLC6A2HTR2CHTR2BPIM1
SCHEMBL6495270 0.74 HTR6 (0.60) HTR1A
SCHEMBL6502257 0.73 HTR6 (0.50) HTR1ASLC6A2PIM1PIM2
SCHEMBL6500751 0.73 HTR6 (0.51) PIM1PIM2
Hydrochloric Acid SCHEMBL6962825 0.73 SLC6A2 (0.55) HTR1ASLC6A2HTR2CHTR2BSLC6A4
Hydrochloric Acid SCHEMBL6169239 0.72 HTR1A (0.48) HTR1ASLC6A2HTR2CSLC6A4SLC6A3

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-0863136-B1 Derivatives of azetidine and pyrrolidine AKZO NOBEL NV (NL) 2003-09-24 EP claimed