SCHEMBL4478628

SCHEMBL4478628

CNC(=O)c1coc(CNC(=O)NC[C@H]2CN(C(C)c3ccc(Cl)c(Cl)c3)CCO2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 4/20 0.45
KCNH2 Q12809 2/20 0.39
CCR2 P41597 1/20 0.39
HRH1 P35367 2/20 0.34
CACNA1H O95180 1/20 0.34
TAOK1 Q7L7X3 1/20 0.33
TAOK3 Q9H2K8 1/20 0.33
KMT2A Q03164 2/20 0.33
P2RX7 Q99572 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
EPHA2 P29317 1/20 0.32
KDR P35968 1/20 0.32
EPHB4 P54760 1/20 0.32
CXCR3 P49682 1/20 0.32
PPARA Q07869 1/20 0.32
SLC5A7 Q9GZV3 1/20 0.32
S1PR1 P21453 2/20 0.32
ESR1 P03372 1/20 0.32
NR3C1 P04150 1/20 0.32
PGR P06401 1/20 0.32

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
SCHEMBL4485562 0.83 CCR3 (0.66) CCR3KCNH2CCR2CACNA1HKMT2A
SCHEMBL7104200 0.80 CCR3 (0.70) CCR3KCNH2CCR2HRH1TAOK1
SCHEMBL5619221 0.80 CCR3 (0.70) CCR3KCNH2CCR2HRH1TAOK1
SCHEMBL4474929 0.79 CCR2 (0.48) CCR3KCNH2CCR2HRH1P2RX7
SCHEMBL4484994 0.78 CCR3 (0.45) CCR3KCNH2CCR2HRH1CACNA1H
SCHEMBL4487731 0.78 CCR3 (0.63) CCR3KCNH2CACNA1HKMT2A
SCHEMBL4677378 0.76 CCR3 (0.65) CCR3KCNH2CCR2CACNA1HKMT2A
SCHEMBL13631396 0.76 CCR3 (0.70) CCR3KCNH2CCR2CACNA1HKMT2A
SCHEMBL13631405 0.75 CCR3 (0.42) CCR3KCNH2CCR2HRH1EPHA2
Hydrochloric Acid SCHEMBL4488350 0.75 CCR3 (0.69) CCR3KCNH2CCR2CACNA1HKMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622464-B2 Morpholinyl-urea derivatives for use in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2009-11-24 US disclosed
US-7622464-B2 Morpholinyl-urea derivatives for use in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2009-11-24 US disclosed
US-7622464-B2 Morpholinyl-urea derivatives for use in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2009-11-24 US disclosed
EP-1487828-B1 MORPHOLINYL-UREA DERIVATIVES FOR USE OF THE TREATMENT OF INFLAMATORY DISEASES GLAXO GROUP LTD (GB) 2008-11-05 EP disclosed
EP-1487828-B1 MORPHOLINYL-UREA DERIVATIVES FOR USE OF THE TREATMENT OF INFLAMATORY DISEASES GLAXO GROUP LTD (GB) 2008-11-05 EP disclosed
US-20060063765-A1 Novel compounds GLAXO GROUP LIMITED (GB) 2006-03-23 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-20060063765-A1 Novel compounds CCR3, NSUN3, CCR1 CCR3 1/4885KCNH2 2405/4885CCR2 47/4885

“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.