SCHEMBL7167704

SCHEMBL7167704

CCOC(=O)C1CCN(C[C@@H](C)CN2c3ccccc3CCc3ccc(C)cc32)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
RECQL P46063 1/20 0.46
MAPT P10636 1/20 0.44
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CCR8 P51685 1/20 0.43
MEN1 O00255 1/20 0.42
LTA4H P09960 1/20 0.42

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
SCHEMBL5495300 0.88 LMNA (0.46) ALDH1A1RECQLMAPTKMT2AMEN1
Hydrochloric Acid SCHEMBL7163638 0.87 LMNA (0.45) ALDH1A1RECQLMAPTKMT2AMEN1
SCHEMBL7168001 0.83 ALDH1A1 (0.54) ALDH1A1USP2SMN1; SMN2RECQLMAPT
SCHEMBL7167703 0.82 TSHR (0.44) ALDH1A1MAPTKDM4EKMT2AL3MBTL1
SCHEMBL7167706 0.80 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EKMT2AL3MBTL1
SCHEMBL6968719 0.79 LMNA (0.52) ALDH1A1SMN1; SMN2MAPTKDM4EKMT2A
SCHEMBL7171303 0.79 ALDH1A1 (0.47) ALDH1A1USP2SMN1; SMN2RECQLMAPT
SCHEMBL6961863 0.77 CHRM2 (0.57) ALDH1A1LTA4H
SCHEMBL7172628 0.77 CHRM2 (0.54) ALDH1A1KDM4ELTA4H
SCHEMBL6959063 0.76 DRD2 (0.52) SMN1; SMN2MAPTKDM4EKMT2AMEN1

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
US-6569849-B1 N-Substituted azaheterocyclic compounds NOVO NORDISK A/S (DK) 2003-05-27 US disclosed
EP-0934306-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1999-08-11 EP disclosed
WO-1998015546-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-04-16 WO disclosed