SCHEMBL5236266

SCHEMBL5236266

CNC1(C(C)=O)CN(c2ccc(-c3ccc(OCc4ccccc4)c(F)c3)cc2)CCN1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 3/20 0.41
GAA P10253 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
ERN1 O75460 1/20 0.41
S1PR5 Q9H228 1/20 0.39
GRM2 Q14416 1/20 0.37
HTR6 P50406 2/20 0.37
CTSA P10619 1/20 0.37
FFAR1 O14842 3/20 0.37
PPARD Q03181 2/20 0.37
MAPK1 P28482 2/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ENPP2 Q13822 1/20 0.36
LRRK2 Q5S007 4/20 0.36
USP2 O75604 1/20 0.35

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
SCHEMBL5236699 0.86 CD274 (0.41) MAPTALDH1A1HTR6FFAR1MAPK1
SCHEMBL5236205 0.86 RXRA (0.41) MAPTKDM4EALDH1A1GAATDP1
SCHEMBL5236271 0.84 ERN1 (0.43) MAPTKDM4EALDH1A1GAATDP1
SCHEMBL5236546 0.81 USP2 (0.46) MAPTALDH1A1MAPK1USP2KMT2A
SCHEMBL5232202 0.79 RAB9A (0.40) MAPTKDM4EALDH1A1GAATDP1
SCHEMBL5238577 0.78 GRM5 (0.50) MAPTKDM4EALDH1A1GAATDP1
SCHEMBL5238186 0.77 CYP2C19 (0.43) MAPTALDH1A1MAPK1USP2KMT2A
SCHEMBL5240792 0.76 NAAA (0.42) MAPTALDH1A1MAPK1RAB9ALMNA
SCHEMBL5238647 0.76 USP2 (0.50) ALDH1A1MAPK1USP2KMT2A
SCHEMBL5232288 0.76 MAPT (0.41) MAPTKDM4EALDH1A1GAAMAPK1

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