SCHEMBL5239486

SCHEMBL5239486

CNC1(CC=O)CN(c2ccc(-c3cccc(OC)c3F)cc2)CCN1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.41
FGFR2 P21802 4/20 0.41
ERN1 O75460 1/20 0.36
DRD2 P14416 3/20 0.35
DRD4 P21917 3/20 0.35
DRD3 P35462 3/20 0.35
HSD17B10 Q99714 5/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
DYRK1A Q13627 1/20 0.34
ALDH1A1 P00352 5/20 0.34
CYP3A4 P08684 5/20 0.34
USP2 O75604 4/20 0.34
CYP1A2 P05177 4/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPK1 P28482 2/20 0.34
CYP2C9 P11712 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL5234847 0.84 KMT2A (0.40) HSD17B10MAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL5236705 0.84 CD274 (0.41) ERN1MAPTNPSR1ALDH1A1CYP3A4
SCHEMBL5232294 0.83 ALDH1A1 (0.39) HSD17B10MAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL5236214 0.82 RXRA (0.39) ERN1MAPTNPSR1ALDH1A1SMN1; SMN2
SCHEMBL5239479 0.82 FGFR1 (0.41) FGFR1FGFR2ERN1DRD2DRD4
SCHEMBL5236555 0.82 USP2 (0.41) DRD3HSD17B10MAPTALDH1A1CYP3A4
SCHEMBL5240799 0.81 NAAA (0.40) FGFR1DRD4HSD17B10MAPTALDH1A1
SCHEMBL5233074 0.81 L3MBTL1 (0.44) MAPTALDH1A1MAPK1L3MBTL1MEN1
SCHEMBL5238192 0.80 CYP2C19 (0.37) HSD17B10MAPTNPSR1ALDH1A1CYP3A4
SCHEMBL5234068 0.79 DRD2 (0.45) DRD2DRD4DRD3ALDH1A1CYP3A4

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