SCHEMBL6202280

SCHEMBL6202280

N[C@H]1CCCN(Cc2ccccc2)C1=O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 2/20 0.49
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
ACHE P22303 1/20 0.44
CYP2D6 P10635 2/20 0.43
CYP2C19 P33261 2/20 0.43
POLB P06746 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 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
SCHEMBL3618774 0.95 L3MBTL1 (0.54) L3MBTL1KMT2AMEN1ALDH1A1DDB1
SCHEMBL3245199 0.95 L3MBTL1 (0.54) L3MBTL1KMT2AMEN1ALDH1A1DDB1
SCHEMBL3245339 0.95 L3MBTL1 (0.54) L3MBTL1KMT2AMEN1ALDH1A1DDB1
SCHEMBL12527918 0.94 L3MBTL1 (0.56) L3MBTL1KMT2AMEN1ALDH1A1DDB1
Hydrochloric Acid SCHEMBL12494265 0.94 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1ALDH1A1DDB1
Hydrochloric Acid SCHEMBL12494266 0.94 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1ALDH1A1DDB1
SCHEMBL7933318 0.90 ALDH1A1 (0.47) L3MBTL1KMT2AMEN1ALDH1A1DDB1
SCHEMBL4224772 0.90 ALDH1A1 (0.47) L3MBTL1KMT2AMEN1ALDH1A1DDB1
SCHEMBL4224776 0.90 ALDH1A1 (0.47) L3MBTL1KMT2AMEN1ALDH1A1DDB1
Hydrochloric Acid SCHEMBL6818480 0.89 ALDH1A1 (0.46) L3MBTL1KMT2AMEN1ALDH1A1DDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165532-B1 ANTIBACTERIAL AGENTS VERNALIS OXFORD LTD (GB) 2005-01-12 EP disclosed
US-6503897-B1 N-Formylhydroxylamine derivatives; veterinary medicine; grampositive and gramnegative bacteria BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 2003-01-07 US disclosed
EP-1165532-A1 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2002-01-02 EP disclosed
WO-2000058294-A1 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-10-05 WO disclosed