SCHEMBL8214788

SCHEMBL8214788

OC[C@H]1CCC[C@@H](NCc2cccc(OC(F)(F)F)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.53
CARM1 Q86X55 2/20 0.53
PRMT6 Q96LA8 2/20 0.53
ALDH1A1 P00352 1/20 0.49
SCN9A Q15858 4/20 0.44
EPHX1 P07099 1/20 0.43
BCHE P06276 2/20 0.42
ACHE P22303 2/20 0.42
BACE1 P56817 2/20 0.42
MAPK14 Q16539 1/20 0.42
RIPK2 O43353 1/20 0.41
PRMT5 O14744 2/20 0.40
WDR77 Q9BQA1 2/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
PIM1 P11309 2/20 0.39
GLS O94925 1/20 0.39
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM5B Q9UGL1 1/20 0.39

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
SCHEMBL8206265 1.00 MCHR1 (0.53) MCHR1CARM1PRMT6ALDH1A1SCN9A
SCHEMBL4590689 1.00 MCHR1 (0.53) MCHR1CARM1PRMT6ALDH1A1SCN9A
SCHEMBL4575076 0.81 MCHR1 (0.55) MCHR1CARM1PRMT6ALDH1A1SCN9A
SCHEMBL2466378 0.81 CARM1 (0.68) MCHR1CARM1PRMT6ALDH1A1EPHX1
SCHEMBL29456931 0.81 CARM1 (0.68) MCHR1CARM1PRMT6ALDH1A1EPHX1
SCHEMBL8208302 0.79 MCHR1 (0.57) MCHR1CARM1PRMT6ALDH1A1SCN9A
SCHEMBL4590922 0.79 CARM1 (0.57) MCHR1CARM1PRMT6ALDH1A1SCN9A
SCHEMBL8214422 0.79 CARM1 (0.54) MCHR1CARM1PRMT6ALDH1A1SCN9A
SCHEMBL1006996 0.78 CARM1 (0.61) MCHR1CARM1PRMT6ALDH1A1EPHX1
SCHEMBL4590508 0.76 CARM1 (0.57) MCHR1CARM1PRMT6ALDH1A1SCN9A

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
WO-2008065500-A2 HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2008-06-05 WO disclosed