SCHEMBL6174497

SCHEMBL6174497

O=C(O)c1cccc(N2CCN(CCO)CC2)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.65
MEN1 O00255 1/20 0.65
ALDH1A1 P00352 1/20 0.65
GAA P10253 1/20 0.65
HPGD P15428 1/20 0.65
KMT2A Q03164 1/20 0.65
HSD17B10 Q99714 1/20 0.65
KMO O15229 1/20 0.60
TTR P02766 1/20 0.54
ENPP2 Q13822 9/20 0.53
DRD2 P14416 1/20 0.51
HTR2A P28223 1/20 0.51
HTR7 P34969 3/20 0.50
HTR1A P08908 3/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL3230486 0.88 HTR7 (0.59) KDM4EMEN1ALDH1A1GAAHPGD
SCHEMBL4515283 0.83 KDM4E (0.58) KDM4EMEN1ALDH1A1GAAHPGD
SCHEMBL4515279 0.83 KDM4E (0.58) KDM4EMEN1ALDH1A1GAAHPGD
SCHEMBL32688379 0.82 ALDH1A1 (0.80) KDM4EMEN1ALDH1A1GAAHPGD
SCHEMBL5863335 0.82 KDM4E (0.57) KDM4EMEN1ALDH1A1GAAHPGD
SCHEMBL63379 0.81 KDM4E (0.54) KDM4EMEN1KMT2AENPP2DRD2
SCHEMBL29631156 0.81 ALDH1A1 (0.73) KDM4EMEN1ALDH1A1GAAHPGD
SCHEMBL3319386 0.81 ALDH1A1 (0.73) KDM4EMEN1ALDH1A1GAAHPGD
SCHEMBL6420684 0.81 ALOX5 (0.52) MEN1ALDH1A1KMT2ADRD2HTR7
SCHEMBL4021071 0.81 DRD2 (0.68) KDM4EMEN1ALDH1A1GAAHPGD

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-1530564-A2 COMPOUNDS DERIVED FROM ARYL CARBAMATES, PREPARATION THEREOF AND USES OF SAME Cerep (FR) 2005-05-18 EP disclosed
WO-2004018436-A2 COMPOUNDS DERIVED FROM ARYL CARBAMATES, PREPARATION THEREOF AND USES OF SAME CEREP (FR) 2004-03-04 WO disclosed