SCHEMBL5330010

SCHEMBL5330010

COc1ccc(C2CCN(CC(O)C3CCN(C=CC(=O)c4ccc(Cl)c(Cl)c4)CC3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 10/20 0.49
USP2 O75604 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
ALOX12 P18054 1/20 0.43
DRD2 P14416 2/20 0.41
SLC2A1 P11166 1/20 0.41
HRH1 P35367 1/20 0.39
CCR3 P51677 1/20 0.39
KCNH2 Q12809 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
OPRM1 P35372 1/20 0.38
HSD11B1 P28845 1/20 0.38
ADRA1A P35348 1/20 0.38

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
SCHEMBL5323641 0.91 CCR2 (0.47) CCR2USP2ALDH1A1MAPTALOX12
SCHEMBL5354245 0.88 USP2 (0.43) CCR2USP2ALDH1A1MAPTALOX12
SCHEMBL5328087 0.87 CCR2 (0.46) CCR2USP2ALDH1A1MAPTALOX12
SCHEMBL5327777 0.86 DRD2 (0.45) USP2ALDH1A1MAPTALOX12DRD2
SCHEMBL5323601 0.86 CCR2 (0.48) CCR2USP2ALDH1A1MAPTALOX12
SCHEMBL5324768 0.85 CCR2 (0.49) CCR2USP2ALDH1A1MAPTALOX12
SCHEMBL5322784 0.83 CCR2 (0.45) CCR2USP2ALDH1A1MAPTALOX12
SCHEMBL5330013 0.79 CCR2 (0.77) CCR2ALDH1A1MAPTNPC1
SCHEMBL14387101 0.79 CCR2 (0.77) CCR2ALDH1A1MAPTNPC1
SCHEMBL14430057 0.79 MAPT (0.55) CCR2MAPTKCNH2NPC1LMNA

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 1/4885USP2 3962/4885ALDH1A1 905/4885

“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.