SCHEMBL5326953

SCHEMBL5326953

O=C(C=CN1CCC(O)(C(O)CN2CCC(c3ccc(Cl)cc3)CC2)CC1)c1cc(F)c(F)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 7/20 0.44
DRD2 P14416 3/20 0.39
HSD11B1 P28845 1/20 0.38
CCR1 P32246 2/20 0.37
P2RY1 P47900 1/20 0.36
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
PRCP P42785 1/20 0.35
SLC18A3 Q16572 1/20 0.34

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
SCHEMBL5351797 0.93 DRD2 (0.37) CCR2DRD2CCR1SLC18A3
SCHEMBL5350435 0.92 DRD2 (0.41) CCR2DRD2HSD11B1CCR1DRD4
SCHEMBL5333448 0.90 TACR1 (0.36) CCR2SIGMAR1
SCHEMBL5324486 0.89 CCR2 (0.46) CCR2DRD2SIGMAR1
SCHEMBL5326988 0.87 DRD2 (0.39) CCR2DRD2HSD11B1CCR1SLC18A3
SCHEMBL5328485 0.86 DRD2 (0.38) CCR2DRD2CCR1SLC18A3
SCHEMBL5325882 0.84 CCR1 (0.36) CCR2CCR1SIGMAR1
SCHEMBL5325741 0.84 DRD2 (0.40) CCR2DRD2HSD11B1CCR1
SCHEMBL5325494 0.84 MAPT (0.45) CCR2DRD2HSD11B1SIGMAR1
SCHEMBL5326187 0.83 USP2 (0.41) CCR2DRD2SIGMAR1

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
WO-2007130712-A1 SUBSTITUTED DIPIPERIDINE AS CCR2 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES JANSSEN PHARMACEUTICA, NV (BE) 2007-11-15 WO claimed
US-20070197590-A1 SUBSTITUTED DIPIPERIDINE CCR2 ANTAGONISTS JANSSEN PHARMACEUTCA N.V. (BE) 2007-08-23 US claimed
WO-2007130712-A1 SUBSTITUTED DIPIPERIDINE AS CCR2 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES JANSSEN PHARMACEUTICA, NV (BE) 2007-11-15 WO disclosed
US-20070197590-A1 SUBSTITUTED DIPIPERIDINE CCR2 ANTAGONISTS JANSSEN PHARMACEUTCA N.V. (BE) 2007-08-23 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-20070197590-A1 SUBSTITUTED DIPIPERIDINE CCR2 ANTAGONISTS CCR2, CCR1, CCR5 CCR2 1/4885DRD2 284/4885HSD11B1 1395/4885

“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.