SCHEMBL6153146

SCHEMBL6153146

CN1C2CCC1CC(N1CCN(C(=O)CC3=C(C(=O)O)C(c4c(Cl)cccc4Cl)C(C(=O)O)=C(CCc4ccccc4CSc4ccccc4)N3)CC1)C2

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 7/20 0.34
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 3/20 0.33
MAPK1 P28482 1/20 0.32
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL6154279 0.93 CCR3 (0.33) CCR3ALDH1A1KDM4EMAPK1MAPT
SCHEMBL6152408 0.91 CCR3 (0.36) CCR3ALDH1A1KDM4EMAPK1MEN1
SCHEMBL6943528 0.89 CCR3 (0.36) CCR3ALDH1A1KDM4EMAPK1MEN1
SCHEMBL6152430 0.88 CCR3 (0.34) CCR3ALDH1A1KDM4EMAPK1MEN1
SCHEMBL7838559 0.87 SIGMAR1 (0.42) CCR3ALDH1A1KDM4EMAPTMEN1
SCHEMBL6152832 0.86 CCR3 (0.33) CCR3ALDH1A1KDM4EMAPK1
SCHEMBL6152863 0.86 MEN1 (0.36) CCR3ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6152716 0.86 CCR3 (0.33) CCR3ALDH1A1KDM4EMAPK1
SCHEMBL6152975 0.85 CCR3 (0.33) CCR3ALDH1A1KDM4EKMT2A
SCHEMBL6946279 0.85 RXFP1 (0.37) CCR3ALDH1A1KDM4EMEN1KMT2A

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 CCR3 221/4885ALDH1A1 1798/4885KDM4E 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.