SCHEMBL8212416

SCHEMBL8212416

FC(F)(F)Oc1cccc(CNC2CCC3(CC2)OCCO3)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 3/20 0.56
PRMT6 Q96LA8 3/20 0.56
ALDH1A1 P00352 1/20 0.47
BCHE P06276 2/20 0.45
ACHE P22303 2/20 0.45
BACE1 P56817 2/20 0.45
MCHR1 Q99705 1/20 0.43
RIPK2 O43353 1/20 0.42
CXCR3 P49682 1/20 0.41
MAPK14 Q16539 1/20 0.40
KDM5A P29375 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
EPHX1 P07099 1/20 0.40
KCNN3 Q9UGI6 1/20 0.39
CCNT1 O60563 1/20 0.39
DRD4 P21917 1/20 0.39
GLS O94925 1/20 0.38
TACR1 P25103 1/20 0.38
ROCK2 O75116 1/20 0.38

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
SCHEMBL29456931 0.85 CARM1 (0.68) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL2466378 0.85 CARM1 (0.68) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL375222 0.84 CARM1 (0.61) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL1006996 0.79 CARM1 (0.61) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL4575142 0.78 CARM1 (0.60) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL803482 0.77 OPRM1 (0.56) CARM1PRMT6BCHEACHEBACE1
SCHEMBL8217923 0.76 CARM1 (0.59) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL8216669 0.76 CARM1 (0.61) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL4590922 0.75 CARM1 (0.57) CARM1PRMT6ALDH1A1BCHEACHE
SCHEMBL14833259 0.75 MGLL (0.44)

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