SCHEMBL1811963

SCHEMBL1811963

CC(=O)N(C[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)CCO1)Sc1nc(C(=O)N[C@@H](C)C(=O)OCc2ccccc2)cs1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 10/20 0.41
CCR3 P51677 1/20 0.36
CTSK P43235 1/20 0.36
EPHA2 P29317 1/20 0.36
KDR P35968 1/20 0.36
EPHB4 P54760 1/20 0.36
DRD2 P14416 2/20 0.34
DRD3 P35462 2/20 0.34
CNR2 P34972 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PPARG P37231 1/20 0.33
SIGMAR1 Q99720 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
SCHEMBL1812316 0.91 CCR3 (0.40) DRD4CCR3DRD3CNR2PPARG
Hydrochloric Acid SCHEMBL1809459 0.90 CCR3 (0.39) DRD4CCR3EPHA2KDREPHB4
Hydrochloric Acid SCHEMBL1807020 0.85 GRN (0.44) DRD4CCR3CNR2
SCHEMBL1811965 0.85 ALDH1A1 (0.48) DRD4CCR3DRD3ALDH1A1SIGMAR1
SCHEMBL1811962 0.85 ALDH1A1 (0.48) DRD4CCR3DRD3ALDH1A1SIGMAR1
SCHEMBL1810235 0.84 DRD4 (0.44) DRD4CCR3CNR2SIGMAR1
SCHEMBL1812698 0.84 CCR3 (0.41) DRD4CCR3DRD3CNR2SIGMAR1
SCHEMBL1813440 0.83 CCR3 (0.42) DRD4CCR3DRD2DRD3SIGMAR1
Hydrochloric Acid SCHEMBL1809318 0.83 CCR3 (0.42) DRD4CCR3DRD3CNR2ALDH1A1
Hydrochloric Acid SCHEMBL1808736 0.83 CCR3 (0.40) DRD4CCR3EPHA2KDRDRD3

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-1801108-B9 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2013-11-20 EP disclosed
EP-1801108-B1 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2012-11-14 EP disclosed
US-7935700-B2 Morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-03 US disclosed
US-20070265257-A1 Morpholine Compound MITSUBISHI PHARMA CORPORATION (JP) 2007-11-15 US disclosed
EP-1801108-A1 MORPHOLINE COMPOUND Mitsubishi Pharma Corporation (JP) 2007-06-27 EP 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-20070265257-A1 Morpholine Compound CCR3, CCR1, CCR4 DRD4 768/4885CCR3 1/4885CTSK 1834/4885

“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.