SCHEMBL1421368

SCHEMBL1421368

C[C@H]1COCCN1Cc1cc(C=O)ccc1Br

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.39
LTA4H P09960 1/20 0.38
ALDH3A1 P30838 1/20 0.36
ALDH1A3 P47895 1/20 0.36
GRM2 Q14416 3/20 0.36
CYP2A13 Q16696 1/20 0.36
PIK3C3 Q8NEB9 6/20 0.36
MTOR P42345 1/20 0.35
CBLB Q13191 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CNR2 P34972 1/20 0.33

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
SCHEMBL1421372 1.00 SIRT6 (0.39) SIRT6LTA4HALDH3A1ALDH1A3GRM2
SCHEMBL1421405 0.78 LRRK2 (0.40) SIRT6LTA4HMTOR
SCHEMBL1421406 0.78 LRRK2 (0.40) SIRT6LTA4HMTOR
SCHEMBL1421682 0.74 CNR2 (0.40) SIRT6LTA4HGRM2CYP2A13CBLB
SCHEMBL3210795 0.74 CNR2 (0.40) SIRT6LTA4HGRM2CYP2A13CBLB
SCHEMBL632786 0.72 SIRT6 (0.47) SIRT6LTA4HGRM2PIK3C3MTOR
SCHEMBL632787 0.72 SIRT6 (0.47) SIRT6LTA4HGRM2PIK3C3MTOR
SCHEMBL633549 0.71 LTA4H (0.47) SIRT6LTA4HGRM2MTORALDH1A1
SCHEMBL632417 0.71 LTA4H (0.47) SIRT6LTA4HGRM2MTORALDH1A1
SCHEMBL632416 0.71 LTA4H (0.47) SIRT6LTA4HGRM2MTORALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2778156-B1 Phenoxypyridinylamide derivatives and their use in the treatment of PDE4 mediated disease states ASTRAZENECA AB (SE) 2016-11-30 EP disclosed
EP-2778156-A1 Phenoxypyridinylamide derivatives and their use in the treatment of PDE4 mediated disease states AstraZeneca AB (Publ) (SE) 2014-09-17 EP disclosed
US-8273774-B2 Phenoxypyridinylamide compounds ASTRAZENECA AB (SE) 2012-09-25 US disclosed
EP-2297106-A1 PHENOXYPYRIDINYLAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PDE4 MEDIATED DISEASE STATES AstraZeneca AB (SE) 2011-03-23 EP disclosed
US-20100041638-A1 Chemical Compounds 293 ASTRAZENECA AB (SE) 2010-02-18 US disclosed
WO-2009144494-A1 PHENOXYPYRIDINYLAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PDE4 MEDIATED DISEASE STATES ASTRAZENECA AB (SE) 2009-12-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100041638-A1 Chemical Compounds 293 PDE4B, PDE4A, PDE3B SIRT6 747/4885LTA4H 174/4885ALDH3A1 498/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.