SCHEMBL5212355

SCHEMBL5212355

O=C(O)N1CCC(CCOc2ccc(-c3ccc(Cl)cc3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.54
TEAD3 Q99594 1/20 0.54
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
HPGD P15428 3/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 1/20 0.51
HRH2 P25021 1/20 0.47
HRH1 P35367 1/20 0.47
CHEK2 O96017 1/20 0.46
RAB9A P51151 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HRH3 Q9Y5N1 4/20 0.46
ADAMTS5 Q9UNA0 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
KCNA5 P22460 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ATF4 P18848 1/20 0.44
USP2 O75604 1/20 0.44

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
SCHEMBL3830625 0.84 TEAD1 (0.73) TEAD1TEAD3KMT2AMEN1HPGD
SCHEMBL28064208 0.83 TEAD1 (0.57) TEAD1TEAD3KMT2AMEN1ALDH1A1
SCHEMBL5208507 0.83 TEAD1 (0.57) TEAD1TEAD3KMT2AMEN1ALDH1A1
SCHEMBL28802165 0.81 TEAD1 (0.55) TEAD1TEAD3HPGDALDH1A1CHEK2
SCHEMBL2463633 0.80 FAAH (0.69) TEAD1TEAD3KMT2AMEN1HPGD
SCHEMBL4322579 0.80 GPR119 (0.65) KMT2AMEN1HPGDALDH1A1LMNA
SCHEMBL3356937 0.80 TEAD1 (0.60) TEAD1TEAD3KMT2AALDH1A1LMNA
SCHEMBL20744741 0.79 TEAD1 (0.53) TEAD1TEAD3KMT2AMEN1
SCHEMBL23453708 0.78 NFE2L2 (0.53) TEAD1TEAD3HPGD
SCHEMBL2792293 0.77 TEAD1 (0.47) TEAD1TEAD3KMT2AMEN1HPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1708994-B1 ARYLOXYALKYLCARBAMATE-TYPE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2007-08-08 EP claimed
EP-1708994-B1 ARYLOXYALKYLCARBAMATE-TYPE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2007-08-08 EP disclosed