SCHEMBL5212277

SCHEMBL5212277

O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.54
LMNA P02545 5/20 0.53
MAPT P10636 2/20 0.53
GRIN1 Q05586 1/20 0.53
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
GAA P10253 3/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ACLY P53396 1/20 0.49
MAPK1 P28482 1/20 0.49
NLRP1 Q9C000 1/20 0.49
ERCC1 P07992 1/20 0.49
ERCC4 Q92889 1/20 0.49
TP53 P04637 1/20 0.47
KDM4E B2RXH2 1/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL5641667 0.83 GRIN1 (0.67) SMN1; SMN2LMNAMAPTGRIN1ALDH1A1
SCHEMBL3461761 0.82 SMN1; SMN2 (0.60) TTRSMN1; SMN2LMNAMAPTGRIN1
SCHEMBL5646507 0.82 LMNA (0.70) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL5724332 0.81 ERCC1 (0.57) TTRSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL2912570 0.78 SMN1; SMN2 (0.82) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL29941278 0.76 ERCC1 (0.59) SMN1; SMN2GRIN1ALDH1A1HPGDGAA
SCHEMBL5723707 0.76 L3MBTL1 (0.51) LMNAMAPTALDH1A1HPGDGAA
SCHEMBL16641981 0.75 CA12 (0.63) LMNAMAPTALDH1A1HPGDGAA
SCHEMBL5725206 0.75 ERCC1 (0.57) SMN1; SMN2MAPTGRIN1ALDH1A1HPGD
SCHEMBL7195008 0.75 GRM5 (0.49) SMN1; SMN2LMNAMAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1633715-B1 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS PFIZER LTD (GB) 2007-09-05 EP disclosed
EP-1633715-A1 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS Pfizer Limited (GB) 2006-03-15 EP disclosed
WO-2004108676-A1 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS PFIZER LIMITED (GB) 2004-12-16 WO disclosed