SCHEMBL5832763

SCHEMBL5832763

O=C(COc1ccccc1)NCC1CN(CCCc2ccc(Cl)c(Cl)c2)CCO1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 6/20 0.54
SMN1; SMN2 Q16637 1/20 0.51
CCR3 P51677 1/20 0.47
FAAH O00519 4/20 0.46
ACHE P22303 4/20 0.46
BCHE P06276 2/20 0.46
SIGMAR1 Q99720 2/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2B Q13224 1/20 0.44
ERBB2 P04626 1/20 0.44
EPHA2 P29317 1/20 0.44
KDR P35968 1/20 0.44
EPHB4 P54760 1/20 0.44
LIPG Q9Y5X9 1/20 0.43
MCHR1 Q99705 1/20 0.43
LTA4H P09960 1/20 0.43

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
SCHEMBL4022970 0.89 DRD4 (0.68) DRD4SMN1; SMN2CCR3FAAHACHE
SCHEMBL4023483 0.87 SIGMAR1 (0.51) DRD4CCR3SIGMAR1ERBB2EPHA2
SCHEMBL4226689 0.81 CCR3 (0.60) DRD4SMN1; SMN2CCR3FAAHACHE
SCHEMBL4226695 0.81 CCR3 (0.60) DRD4SMN1; SMN2CCR3FAAHACHE
SCHEMBL4215947 0.78 CCR3 (0.59) DRD4CCR3FAAHACHESIGMAR1
SCHEMBL4215942 0.78 CCR3 (0.59) DRD4CCR3FAAHACHESIGMAR1
SCHEMBL5777113 0.76 DRD4 (0.65) DRD4CCR3SIGMAR1
SCHEMBL4024938 0.76 CCR3 (0.62) DRD4CCR3SIGMAR1
SCHEMBL5770729 0.75 CCR3 (0.66) DRD4CCR3SIGMAR1
SCHEMBL1810669 0.74 CCR3 (0.62) DRD4CCR3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1324990-B1 MORPHOLIN-ACETAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LTD (GB) 2014-10-29 EP claimed
US-7101882-B2 Morpholin-acetamide derivatives for the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2006-09-05 US claimed
US-20040058923-A1 Morpholin-acetamide derivatives for the treatment of inflammatory diseases SMITHKLINE BEECHAM CORPORATION 2004-03-25 US claimed
EP-1324990-B1 MORPHOLIN-ACETAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LTD (GB) 2014-10-29 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-20040058923-A1 Morpholin-acetamide derivatives for the treatment of inflammatory diseases CCR1, MALT1, REL DRD4 3922/4885SMN1; SMN2 1217/4885CCR3 7/4885

“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.