SCHEMBL5238376

SCHEMBL5238376

CCOc1ccc(-c2ccc(N3CCN(C(=O)O)CC3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.54
MAPK1 P28482 3/20 0.54
PKM P14618 1/20 0.54
ALDH1A1 P00352 5/20 0.53
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
HSD17B10 Q99714 2/20 0.51
ALOX15 P16050 1/20 0.51
GAA P10253 3/20 0.50
LMNA P02545 2/20 0.50
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ME2 P23368 1/20 0.48
ME1 P48163 1/20 0.48
ME3 Q16798 1/20 0.48
FKBP1A P62942 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL5232584 0.87 RXRA (0.59) MAPTMAPK1PKMKMT2AMEN1
SCHEMBL5473090 0.85 KMT2A (0.62) MAPTALDH1A1KMT2AMEN1HSD17B10
SCHEMBL14207944 0.84 MAPT (0.60) MAPTMAPK1PKMALDH1A1KMT2A
SCHEMBL27363642 0.81 MAPT (0.65) MAPTMAPK1ALDH1A1KMT2AMEN1
SCHEMBL17107398 0.81 THRA (0.60) MAPTALDH1A1HSD17B10GAALMNA
SCHEMBL3319476 0.80 KMT2A (0.47) MAPTMAPK1ALDH1A1KMT2AMEN1
SCHEMBL5239162 0.79 MAPT (0.53) MAPTMAPK1PKMALDH1A1KMT2A
SCHEMBL11058549 0.79 KMT2A (0.51) MAPTMAPK1PKMALDH1A1KMT2A
SCHEMBL632352 0.79 L3MBTL1 (0.73) MAPTMAPK1ALDH1A1GAALMNA
SCHEMBL27620090 0.78 MAPT (0.57) MAPTMAPK1ALDH1A1GAALMNA

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