SCHEMBL5752863

SCHEMBL5752863

CCOC(=O)C1CCN(Cc2ccccc2)CC1=O.CCOC(=O)C1CCN(Cc2ccccc2)CC1O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 4/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CCR8 P51685 1/20 0.45
KDM4E B2RXH2 4/20 0.44
BCHE P06276 2/20 0.42
ACHE P22303 2/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL4862883 0.89 L3MBTL1 (0.57) L3MBTL1ATMALDH1A1CCR8KDM4E
SCHEMBL184071 0.89 MEN1 (0.56) L3MBTL1ATMALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL28818373 0.88 L3MBTL1 (0.56) L3MBTL1ATMALDH1A1CCR8KDM4E
Hydrochloric Acid SCHEMBL184070 0.88 MEN1 (0.55) L3MBTL1ATMALDH1A1MEN1KMT2A
SCHEMBL5413556 0.83 L3MBTL1 (0.57) L3MBTL1ATMALDH1A1MEN1KMT2A
SCHEMBL5751253 0.81 MAPT (0.53) L3MBTL1ATMALDH1A1CCR8KDM4E
SCHEMBL3551153 0.81 L3MBTL1 (0.57) L3MBTL1ATMALDH1A1CCR8KDM4E
SCHEMBL21593409 0.81 L3MBTL1 (0.57) L3MBTL1ATMALDH1A1CCR8KDM4E
SCHEMBL21593413 0.81 L3MBTL1 (0.57) L3MBTL1ATMALDH1A1CCR8KDM4E
SCHEMBL3548161 0.81 L3MBTL1 (0.57) L3MBTL1ATMALDH1A1CCR8KDM4E

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-1646621-A2 NOVEL AZAHETEROCYCLIC AMIDES USEFUL FOR TREATING PAIN Abbott Laboratories (US) 2006-04-19 EP disclosed
WO-2005007642-A2 NOVEL AZAHETEROCYCLIC AMIDES USEFUL FOR TREATING PAIN ABBOTT LABORATORIES (US) 2005-01-27 WO disclosed