SCHEMBL1811602

SCHEMBL1811602

NC(=O)Cc1csc(SCC(=O)NCC2CN(Cc3ccc(Cl)cc3)CCO2)n1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.44
CCR3 P51677 2/20 0.44
DRD4 P21917 13/20 0.43
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.39
DRD2 P14416 1/20 0.39
UBE2N P61088 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CCR1 P32246 1/20 0.39

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
SCHEMBL1811607 1.00 ALDH1A1 (0.50) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1810278 0.93 CCR3 (0.53) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1810283 0.93 CCR3 (0.53) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1808947 0.93 ALDH1A1 (0.48) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1808941 0.93 ALDH1A1 (0.48) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1811480 0.93 ALDH1A1 (0.49) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1811470 0.93 ALDH1A1 (0.49) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1810420 0.93 ALDH1A1 (0.53) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1810423 0.93 ALDH1A1 (0.53) ALDH1A1L3MBTL1CCR3DRD4HPGD
SCHEMBL1812074 0.92 ALDH1A1 (0.47) ALDH1A1L3MBTL1CCR3DRD4HPGD

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 ALDH1A1 2661/4885L3MBTL1 1798/4885CCR3 1/4885

“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.