SCHEMBL5328480

SCHEMBL5328480

COc1ccc(C2CCN(CC(O)C3(O)CCN(C(=O)C=Cc4cc(F)cc(F)c4)CC3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 17/20 0.55
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
PTGS2 P35354 1/20 0.42

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
SCHEMBL14386899 1.00 CCR2 (0.55) CCR2ALDH1A1MAPTPTGS2
SCHEMBL5324488 0.93 CCR2 (0.56) CCR2ALDH1A1MAPT
SCHEMBL14387012 0.93 CCR2 (0.56) CCR2ALDH1A1MAPT
SCHEMBL14430089 0.91 CCR2 (0.46) CCR2ALDH1A1
SCHEMBL5328490 0.91 CCR2 (0.46) CCR2ALDH1A1
SCHEMBL14430077 0.90 CCR2 (0.55) CCR2ALDH1A1MAPTPTGS2
SCHEMBL5326189 0.90 CCR2 (0.55) CCR2ALDH1A1MAPTPTGS2
SCHEMBL14386862 0.89 CCR2 (0.54) CCR2
SCHEMBL5350439 0.89 CCR2 (0.54) CCR2
SCHEMBL14430078 0.87 CCR2 (0.56) CCR2ALDH1A1MAPTPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1/4885ALDH1A1 905/4885MAPT 4100/4885

“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.