SCHEMBL2657576

SCHEMBL2657576

CCN(CC)C(=O)c1ncccc1Br

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
HPGD P15428 7/20 0.44
HCRTR1 O43613 8/20 0.44
HCRTR2 O43614 8/20 0.44
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 6/20 0.43
MAPT P10636 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.41
MLYCD O95822 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL29079317 0.85 HCRTR1 (0.40) HCRTR1HCRTR2KMT2A
SCHEMBL30614424 0.85 HCRTR1 (0.40) HCRTR1HCRTR2KMT2A
SCHEMBL8872750 0.85 EGLN2 (0.47) APOBEC3AAPOBEC3GHPGDHCRTR1HCRTR2
SCHEMBL29265660 0.80 APOBEC3A (0.45) APOBEC3AAPOBEC3GHPGDHCRTR1HCRTR2
SCHEMBL10514737 0.80 ALDH1A1 (0.50) APOBEC3AAPOBEC3GHPGDHCRTR1HCRTR2
SCHEMBL10515422 0.78 ALDH1A1 (0.48) APOBEC3AAPOBEC3GHPGDHCRTR1HCRTR2
SCHEMBL17007538 0.77 HCRTR1 (0.46) APOBEC3AAPOBEC3GHPGDHCRTR1HCRTR2
SCHEMBL2893762 0.75 L3MBTL1 (0.40) HCRTR1HCRTR2KMT2AALDH1A1MAPT
SCHEMBL5313640 0.74 ALDH1A1 (0.45) HPGDHCRTR1HCRTR2KMT2AALDH1A1
SCHEMBL29543454 0.74 ALDH1A1 (0.45) HPGDHCRTR1HCRTR2KMT2AALDH1A1

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-2010520-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS FOR THE PREVENTION AND TREATMENT OF GLUCOKINASE-MEDIATED DISEASES Pfizer Products Incorporated (US) 2009-01-07 EP disclosed
WO-2007122482-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS FOR THE PREVENTION AND TREATMENT OF GLUCOKINASE-MEDIATED DISEASES PFIZER PRODUCTS INC. (US) 2007-11-01 WO disclosed