SCHEMBL5239098

SCHEMBL5239098

CNC1(CC=O)CN(c2ccc(Cl)cc2)CCN1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
THRB P10828 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DRD4 P21917 6/20 0.37
DRD2 P14416 5/20 0.37
LMNA P02545 3/20 0.37
AKR1C3 P42330 2/20 0.36
MMP14 P50281 1/20 0.36
ADAMTS5 Q9UNA0 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTR1A P08908 2/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
GFER P55789 1/20 0.36
HTR7 P34969 1/20 0.36

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
SCHEMBL5235446 0.97 ALDH1A1 (0.37) MEN1KMT2AALDH1A1MAPTTHRB
SCHEMBL5239788 0.89 MAPT (0.43) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL5238192 0.89 CYP2C19 (0.37) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL5239869 0.88 MARS1 (0.36) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5236743 0.88 ALDH1A1 (0.45) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL5236555 0.87 USP2 (0.41) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL5236419 0.87 ADAMTS5 (0.39) KMT2AALDH1A1MAPTADAMTS5
SCHEMBL5233074 0.86 L3MBTL1 (0.44) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL5232377 0.86 SMN1; SMN2 (0.37) MEN1KMT2AALDH1A1MAPTTHRB
SCHEMBL5236154 0.85 POLB (0.38) MAPTGFER

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