SCHEMBL5324731

SCHEMBL5324731

O=C(O)C1CCN(C(=O)C=Cc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.66
RAB9A P51151 3/20 0.66
TDP1 Q9NUW8 1/20 0.66
GPR183 P32249 6/20 0.61
ITGAL P20701 1/20 0.60
CCR2 P41597 9/20 0.57
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 1/20 0.50

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
SCHEMBL5324726 1.00 NPC1 (0.66) NPC1RAB9ATDP1GPR183ITGAL
SCHEMBL27492009 0.88 ITGAL (0.73) ITGAL
SCHEMBL4519049 0.86 NPC1 (0.73) NPC1RAB9ATDP1GPR183ITGAL
SCHEMBL4505160 0.86 NPC1 (0.69) NPC1RAB9ATDP1GPR183CCR2
SCHEMBL4519044 0.86 NPC1 (0.73) NPC1RAB9ATDP1GPR183ITGAL
SCHEMBL4505167 0.86 NPC1 (0.69) NPC1RAB9ATDP1GPR183CCR2
SCHEMBL4502010 0.85 NPC1 (0.67) NPC1RAB9ATDP1GPR183ITGAL
SCHEMBL4502004 0.85 NPC1 (0.67) NPC1RAB9ATDP1GPR183ITGAL
SCHEMBL7302887 0.85 NPC1 (0.63) NPC1RAB9AGPR183ITGALCCR2
SCHEMBL7302886 0.85 NPC1 (0.63) NPC1RAB9AGPR183ITGALCCR2

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 2 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 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 NPC1 677/4885RAB9A 3799/4885TDP1 3488/4885

“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.