SCHEMBL4875968

SCHEMBL4875968

Nc1ccc(Cl)cc1Oc1ccc(Br)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
HPGD P15428 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
TTR P02766 6/20 0.46
MAPT P10636 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A3 Q01959 2/20 0.46
NR1I2 O75469 1/20 0.46
LMNA P02545 1/20 0.46
PGR P06401 1/20 0.46
HSP90AA1 P07900 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
HSPA5 P11021 1/20 0.46
CBR1 P16152 1/20 0.46
TBXA2R P21731 1/20 0.46
AGTR1 P30556 1/20 0.46
CYP3A4 P08684 3/20 0.42
TSHR P16473 3/20 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
SCHEMBL4965689 0.88 TTR (0.58) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL3057422 0.81 ALDH1A1 (0.42) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL7668913 0.78 CYP3A4 (0.52) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL28360593 0.77 TTR (0.50) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL4871473 0.76 SLC6A4 (0.56) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL9272342 0.75 MAPT (0.50) ALDH1A1HPGDTTRMAPTSLC6A2
SCHEMBL2392895 0.75 PDE7A (0.63) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL4875431 0.75 HPGD (0.42) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL11576205 0.75 TTR (0.77) ALDH1A1HPGDL3MBTL1POLBGAA
SCHEMBL3652668 0.74 MAPT (0.63) ALDH1A1HPGDL3MBTL1POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765768-B1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2013-11-06 EP disclosed
CN-102557971-A Substituted acids for the treatment of respiratory diseases ASTRAZENECA AB 2012-07-11 CN disclosed
CN-101014564-B Substituted acids for the treatment of respiratory diseases ASTRAZENECA AB 2012-05-09 CN disclosed
US-20080114002-A1 Substituted Acids for the Treatment of Respiratory Diseases ASTRAZENECA AB (SE) 2008-05-15 US disclosed
CN-101014564-A Substituted acids for the treatment of respiratory diseases ASTRAZENECA AB (SE) 2007-08-08 CN disclosed
EP-1765768-A1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES AstraZeneca AB (SE) 2007-03-28 EP disclosed
WO-2006005909-A1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-01-19 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-20080114002-A1 Substituted Acids for the Treatment of Respiratory Diseases HRH2, HRH1, HRH4 ALDH1A1 1551/4885HPGD 700/4885L3MBTL1 4013/4885

“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.