SCHEMBL5233076

SCHEMBL5233076

CNC(=O)COC(=O)N1CCN(c2ccccc2-c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.50
CXCR3 P49682 1/20 0.47
KCNH2 Q12809 1/20 0.47
HTR1A P08908 9/20 0.47
DRD2 P14416 9/20 0.47
HTR7 P34969 9/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
HTR6 P50406 5/20 0.44
DPP4 P27487 1/20 0.44
FAAH O00519 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL5235199 0.84 GAA (0.53) GAASMN1; SMN2DRD2ALDH1A1MAPT
SCHEMBL5232433 0.84 ALDH1A1 (0.59) GAASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL5237576 0.83 KMT2A (0.53) GAASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL5233512 0.83 MAPT (0.51) GAASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL5239407 0.82 MAPT (0.52) GAASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL5239273 0.82 ALDH1A1 (0.60) LMNAALDH1A1MEN1KMT2A
SCHEMBL5236897 0.81 ALDH1A1 (0.53) GAASMN1; SMN2LMNAHTR1AALDH1A1
SCHEMBL5235922 0.81 HTR1A (0.51) GAASMN1; SMN2HTR1ADRD2ALDH1A1
SCHEMBL5238583 0.80 HSD17B10 (0.57) SMN1; SMN2ALDH1A1MAPTFAAHMEN1
SCHEMBL5237366 0.80 AKR1C3 (0.52) GAASMN1; SMN2ALDH1A1MAPTFAAH

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