SCHEMBL6153062

SCHEMBL6153062

COC(=O)CC1=C(C(=O)O)C(c2c(Cl)cccc2Cl)C(C(=O)O)=C(CCc2ccccc2COCCN2CCCC2)N1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
KDM4E B2RXH2 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33
HTR4 Q13639 1/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
GAA P10253 3/20 0.33
MAPT P10636 1/20 0.33
LTA4H P09960 1/20 0.33
ALDH1A1 P00352 2/20 0.33
BLM P54132 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
SCHEMBL7245208 0.93 POLB (0.39) L3MBTL1KDM4EHRH3KMT2AMEN1
SCHEMBL6152414 0.89 PTAFR (0.37) HPGDL3MBTL1KDM4EHRH3HTR4
SCHEMBL6153190 0.87 SMN1; SMN2 (0.37) HRH3KMT2AMEN1MAPTALDH1A1
SCHEMBL6152961 0.83 HTR1A (0.30)
SCHEMBL6153216 0.83 CCR3 (0.32) KDM4EKMT2AMEN1ALDH1A1
SCHEMBL6152882 0.82 POLB (0.39) L3MBTL1KDM4EHRH3KMT2AMEN1
SCHEMBL6153461 0.82 CYP4F2 (0.34) HPGDKDM4EKMT2AMEN1ALDH1A1
SCHEMBL6153189 0.81 CYP2C9 (0.32) HPGDL3MBTL1KDM4EKMT2AMEN1
Succinic Acid SCHEMBL6152801 0.81 CCR3 (0.31) KDM4EALDH1A1
SCHEMBL7245220 0.81 TBXA2R (0.47) HPGDKDM4EROCK1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307449-B1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMA (JP) 2005-12-07 EP disclosed
US-6653313-B2 For treatment and prevention of inflammation, asthma, allergic rhinitis, pain and other disorders WARNER-LAMBERT COMPANY LLC 2003-11-25 US disclosed
US-20020161006-A1 1,4-dihydropyridine compounds as bradykinin antagonists KAWAMURA MITSUHIRO (US) 2002-10-31 US 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-20020161006-A1 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 HPGD 511/4885L3MBTL1 3714/4885KDM4E 1330/4885

“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.