SCHEMBL6153006

SCHEMBL6153006

CCOC(=O)CCc1ccccc1COCCN1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.57
CYP4F2 P78329 2/20 0.51
CYP4A11 Q02928 2/20 0.51
KDM4E B2RXH2 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 2/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
BCHE P06276 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL6152608 0.90 CYP4F2 (0.54) ALDH1A1CYP4F2CYP4A11KDM4EL3MBTL1
SCHEMBL6152429 0.85 ALDH1A1 (0.53) ALDH1A1KDM4EL3MBTL1KMT2APOLB
SCHEMBL6153686 0.83 ALDH1A1 (0.47) ALDH1A1KDM4EL3MBTL1KMT2AMEN1
SCHEMBL69660 0.74 CYP4F2 (0.86) ALDH1A1CYP4F2CYP4A11KDM4ESMN1; SMN2
SCHEMBL5322002 0.74 MEN1 (0.53) ALDH1A1KDM4EL3MBTL1KMT2AMEN1
SCHEMBL6153020 0.74 CDYL (0.59) ALDH1A1CYP4F2CYP4A11KDM4ESMN1; SMN2
SCHEMBL11281615 0.74 KDM4E (0.50) ALDH1A1KDM4EL3MBTL1KMT2AMEN1
SCHEMBL6153010 0.74 POLB (0.46) ALDH1A1KDM4EL3MBTL1KMT2AMEN1
SCHEMBL6152322 0.73 LTA4H (0.51) ALDH1A1KDM4EL3MBTL1KMT2AMEN1
SCHEMBL1127670 0.73 L3MBTL1 (0.63) ALDH1A1L3MBTL1KMT2APOLBLMNA

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 5 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
EP-1307449-A1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2003-05-07 EP disclosed
US-20020161006-A1 1,4-dihydropyridine compounds as bradykinin antagonists KAWAMURA MITSUHIRO (US) 2002-10-31 US disclosed
WO-2002012235-A1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2002-02-14 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-20020161006-A1 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 ALDH1A1 1798/4885CYP4F2 1994/4885CYP4A11 1123/4885

“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.