SCHEMBL16882199

SCHEMBL16882199

CCOCC1CCN(c2c(C)cccc2C)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ MAPT P10636 4/20 0.39
▸ TDP1 Q9NUW8 3/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ GAA P10253 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ C5AR1 P21730 5/20 0.38
▸ HTT P42858 3/20 0.38
▸ TSHR P16473 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ ALDH1A1 P00352 5/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CHRM2 P08172 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ PRKDC P78527 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ TP53 P04637 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
SCHEMBL15160352 0.86 SLC6A2 (0.43) SLC6A2SLC6A4MAPTTDP1MAPK1
SCHEMBL15158792 0.81 SLC6A2 (0.40) SLC6A2SLC6A4MAPTTDP1MAPK1
SCHEMBL23555133 0.79 SLC6A2 (0.50) SLC6A2SLC6A4MAPTTDP1MAPK1
SCHEMBL15495294 0.79 GRM2 (0.43) MAPTTDP1MAPK1GAAATM
SCHEMBL1688137 0.78 SLC6A2 (0.44) SLC6A2SLC6A4MAPTTDP1MAPK1
SCHEMBL15160355 0.78 MAP4K4 (0.44) SLC6A2SLC6A4MAPTTDP1MAPK1
SCHEMBL21287875 0.73 ALDH1A1 (0.42) SLC6A2SLC6A4MAPTTDP1MAPK1
SCHEMBL23554912 0.73 SLC6A2 (0.38) SLC6A2SLC6A4MAPTTDP1MAPK1
SCHEMBL15158612 0.73 C5AR1 (0.38) SLC6A2SLC6A4MAPTC5AR1HTT
SCHEMBL28263429 0.72 HRH3 (0.48) SLC6A2SLC6A4ALDH1A1

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-9072758-B2 Cyclic amide derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-07-07 — — US disclosed
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