SCHEMBL4144028

SCHEMBL4144028

O=C(O)NC[C@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CCO1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.54
CCR3 P51677 1/20 0.49
HPGD P15428 2/20 0.49
PDE2A O00408 1/20 0.48
JAK2 O60674 1/20 0.47
TSHR P16473 1/20 0.45
POLB P06746 1/20 0.43
HSD11B1 P28845 1/20 0.41
RAB9A P51151 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
EPHA2 P29317 1/20 0.41
KDR P35968 1/20 0.41
EPHB4 P54760 1/20 0.41

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
SCHEMBL5618438 0.84 HPGD (0.54) PKMCCR3HPGDPDE2AJAK2
Hydrochloric Acid SCHEMBL4027477 0.82 PKM (0.58) PKMCCR3HPGDPDE2AJAK2
SCHEMBL3922376 0.78 CCR3 (0.68) CCR3
SCHEMBL4496185 0.78 CCR3 (0.68) CCR3
SCHEMBL4021469 0.78 PKM (0.49) PKMHPGDPDE2AJAK2TSHR
SCHEMBL15937500 0.77 LIPG (0.62) HPGDTSHRLIPG
SCHEMBL4025042 0.77 PDE2A (0.41) PKMCCR3PDE2AJAK2HSD11B1
SCHEMBL4144033 0.76 PKM (0.55) PKMHPGDPDE2ATSHRPOLB
SCHEMBL4021466 0.75 PKM (0.49) PKMHPGDPDE2AJAK2TSHR
SCHEMBL4474929 0.75 CCR2 (0.48) CCR3EPHA2KDREPHB4

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 7 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 disclosed
US-20090163495-A1 MORPHOLIN-ACETAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LIMITED (GB) 2009-06-25 US disclosed
US-7101882-B2 Morpholin-acetamide derivatives for the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2006-09-05 US disclosed
US-20050222147-A1 Process for the preparation of morpholine derivatives and intermediates therefore GLAXO GROUP LIMITED (GB) 2005-10-06 US disclosed
US-20040058923-A1 Morpholin-acetamide derivatives for the treatment of inflammatory diseases SMITHKLINE BEECHAM CORPORATION 2004-03-25 US disclosed
EP-1324990-A1 MORPHOLIN-ACETAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LIMITED (GB) 2003-07-09 EP disclosed
WO-2002026722-A1 MORPHOLIN-ACETAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LIMITED (GB) 2002-04-04 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 (3 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 PKM 3253/4885CCR3 7/4885HPGD 2765/4885
US-20050222147-A1 Process for the preparation of morpholine derivatives and intermediates therefore NISCH, MYO3B, CYP11B2 PKM 838/4885CCR3 4181/4885HPGD 1236/4885
US-20090163495-A1 MORPHOLIN-ACETAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES ARG1, ARG2, NFKBIA PKM 3563/4885CCR3 239/4885HPGD 2274/4885

“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.