SCHEMBL8324336

SCHEMBL8324336

CC(CC1CCNCC1)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.37
CPB2 Q96IY4 1/20 0.37
CYP2D6 P10635 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
TSHR P16473 1/20 0.36
MLNR O43193 1/20 0.36
ABCB11 O95342 1/20 0.36
EGFR P00533 1/20 0.36
FYN P06241 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
HTR1A P08908 1/20 0.36
CHRM5 P08912 1/20 0.36
ADRA2A P08913 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
SCHEMBL11503453 0.90 CPN1 (0.40) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL4314147 0.85 CPN1 (0.33) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL5479967 0.85 SHBG (0.42) MEN1KMT2ATP53CYP1A2SHBG
SCHEMBL2339293 0.85 SHBG (0.42) MEN1KMT2ATP53CYP1A2SHBG
SCHEMBL7392023 0.85 SHBG (0.42) MEN1KMT2ATP53CYP1A2SHBG
SCHEMBL24622520 0.85 SHBG (0.42) MEN1KMT2ATP53CYP1A2SHBG
SCHEMBL5460788 0.85 SHBG (0.42) MEN1KMT2ATP53CYP1A2SHBG
SCHEMBL12817708 0.83 SHBG (0.39) MEN1KMT2ATP53CYP1A2SHBG
SCHEMBL8075546 0.81 SHBG (0.37) MEN1KMT2ACYP1A2SHBG
SCHEMBL22725385 0.78 CPN1 (0.33) CPN1CPB2SLC6A2SLC6A4SLC6A3

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-0604494-B1 5-HT4 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1999-07-28 EP disclosed