SCHEMBL5237607

SCHEMBL5237607

CNC(=O)COC(=O)N1CCN(c2ccc(-c3ccc(OCc4ccccc4)c(F)c3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.47
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
GAA P10253 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
GRM5 P41594 2/20 0.44
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTR6 P50406 1/20 0.42
ERN1 O75460 1/20 0.42
TMEM97 Q5BJF2 2/20 0.41
SIGMAR1 Q99720 2/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
DRD1 P21728 1/20 0.41
HRH2 P25021 1/20 0.41
HTR1B P28222 1/20 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
SCHEMBL5239584 0.86 CD274 (0.45) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL5234008 0.85 GRM5 (0.47) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL5238577 0.84 GRM5 (0.50) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL5233512 0.82 MAPT (0.51) KDM4EMAPTALDH1A1GAAMAPK1
SCHEMBL5239244 0.79 ALDH1A1 (0.52) KDM4EMAPTALDH1A1GAAGRM5
SCHEMBL5236270 0.79 KMT2A (0.49) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL5239407 0.78 MAPT (0.52) KDM4EMAPTALDH1A1GAAGRM5
SCHEMBL5238583 0.77 HSD17B10 (0.57) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL5233900 0.76 ALDH1A1 (0.55) KDM4EMAPTALDH1A1GAAGRM5
SCHEMBL5233951 0.76 MAPT (0.47) KDM4EMAPTALDH1A1GAAMAPK1

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-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed