SCHEMBL5236743

SCHEMBL5236743

CNC1(CC=O)CN(c2cccc(Cl)c2)CCN1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 2/20 0.42
HTT P42858 1/20 0.42
MGLL Q99685 1/20 0.41
TSHR P16473 2/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
RECQL P46063 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTR1A P08908 1/20 0.41
HTR2A P28223 1/20 0.41
HTR7 P34969 1/20 0.41
HTR6 P50406 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
SCHEMBL5234716 0.89 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ARAB9AMAPT
SCHEMBL5238192 0.89 CYP2C19 (0.37) ALDH1A1MEN1KMT2ARAB9AHTT
SCHEMBL5238652 0.88 HSD17B10 (0.44) ALDH1A1SMN1; SMN2MEN1KMT2ATSHR
SCHEMBL5232239 0.88 SCD (0.38) ALDH1A1SMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL5239098 0.88 MEN1 (0.39) ALDH1A1SMN1; SMN2MEN1KMT2AHTT
SCHEMBL5234786 0.87 FFAR4 (0.44) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL5235809 0.87 MAPT (0.44) ALDH1A1SMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL5232337 0.85 LMNA (0.45) ALDH1A1SMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL5235446 0.85 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2MEN1KMT2AHTT
SCHEMBL5236884 0.84 SLC6A7 (0.48) MAPT

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