SCHEMBL2904715

SCHEMBL2904715

O=C(/C=C/c1ccc(Cl)c(Cl)c1)N1CCC(=O)N(CCCN2CCC(O)CC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.54
GPR183 P32249 3/20 0.51
SLC2A1 P11166 2/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PYGL P06737 5/20 0.46

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
SCHEMBL2904719 1.00 CCR2 (0.54) CCR2GPR183SLC2A1NPC1RAB9A
SCHEMBL2899725 0.98 CCR2 (0.54) CCR2GPR183SLC2A1NPC1RAB9A
SCHEMBL2899723 0.98 CCR2 (0.54) CCR2GPR183SLC2A1NPC1RAB9A
SCHEMBL2897314 0.93 CCR2 (0.50) CCR2GPR183SLC2A1NPC1RAB9A
SCHEMBL2903110 0.93 CCR2 (0.54) CCR2GPR183SLC2A1NPC1RAB9A
SCHEMBL2903112 0.93 CCR2 (0.54) CCR2GPR183SLC2A1NPC1RAB9A
SCHEMBL2905012 0.92 CCR2 (0.47) CCR2GPR183SLC2A1PYGL
SCHEMBL2905016 0.92 CCR2 (0.47) CCR2GPR183SLC2A1PYGL
SCHEMBL2902985 0.92 CCR2 (0.53) CCR2GPR183SLC2A1NPC1RAB9A
SCHEMBL2902982 0.92 CCR2 (0.53) CCR2GPR183SLC2A1NPC1RAB9A

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-2010506-B1 DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS HOFFMANN LA ROCHE (CH) 2010-08-04 EP disclosed
US-7632829-B2 Diazepan derivatives HOFFMANN-LA ROCHE INC. (US) 2009-12-15 US disclosed
EP-2010506-A1 DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS F. Hoffmann-Roche AG (CH) 2009-01-07 EP disclosed
WO-2007122103-A1 DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS F. HOFFMANN-LA ROCHE AG (CH) 2007-11-01 WO disclosed
US-20070249589-A1 Novel diazepan derivatives F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2007-10-25 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-20070249589-A1 Novel diazepan derivatives CCR3, CCR1, CCR10 CCR2 8/4885GPR183 86/4885SLC2A1 3754/4885

“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.