SCHEMBL6152317

SCHEMBL6152317

CCN(CC)CCOCc1ccccc1CCC1=C(C(=O)O)C(C)(c2c(Cl)cccc2Cl)C(C(=O)O)=C(CC(=O)OC)N1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.34
SCN1A P35498 2/20 0.34
SCN2A Q99250 2/20 0.34
SCN3A Q9NY46 2/20 0.34
CDYL Q9Y232 1/20 0.34
CHRM2 P08172 6/20 0.33
CHRM1 P11229 5/20 0.33
CYP2D6 P10635 3/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
CYP1A2 P05177 2/20 0.33
SLC22A1 O15245 1/20 0.33
CYP3A4 P08684 1/20 0.33
THRB P10828 1/20 0.33
TSHR P16473 1/20 0.33
PRCP P42785 1/20 0.33
HTT P42858 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL6152925 0.88 L3MBTL1 (0.31)
SCHEMBL6152550 0.87 TDP1 (0.31) TDP1P2RX7
SCHEMBL6151956 0.84
SCHEMBL6152831 0.83 HRH1 (0.35) KDM4EP2RX7
SCHEMBL6153060 0.81 BDKRB1 (0.34) KDM4EALDH1A1
SCHEMBL6152588 0.79 P2RX7 (0.32) KDM4EALDH1A1LMNAP2RX7MEN1
SCHEMBL7240668 0.74 HRH1 (0.34) KDM4EALDH1A1P2RX7MEN1KMT2A
SCHEMBL7252522 0.74 SLC16A3 (0.34)
SCHEMBL7247042 0.73 BDKRB1 (0.34)
SCHEMBL6152316 0.72 TBXA2R (0.39) KDM4ESCN1ASCN2ASCN3ACDYL

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 KDM4E 1330/4885SCN1A 204/4885SCN2A 368/4885

“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.