SCHEMBL5332015

SCHEMBL5332015

O=C(C=CN1CCC(O)(C(O)CN2CCC(O)(c3ccc(F)cc3)CC2)CC1)c1ccc(F)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.45
HTR1A P08908 3/20 0.42
ADRA2A P08913 3/20 0.42
ADRA2B P18089 3/20 0.42
ADRA2C P18825 3/20 0.42
HTR2A P28223 3/20 0.42
ADRA1A P35348 3/20 0.42
HRH1 P35367 3/20 0.42
DRD3 P35462 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2D6 P10635 2/20 0.42
CHRM1 P11229 2/20 0.42
CHRM3 P20309 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
OPRM1 P35372 2/20 0.42
HTR2B P41595 2/20 0.42
SLC6A3 Q01959 2/20 0.42
KCNH2 Q12809 2/20 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
SCHEMBL5353352 0.92 DRD2 (0.41) DRD2HTR1AADRA2AADRA2BADRA2C
SCHEMBL5464718 0.90 DRD2 (0.43) DRD2HTR1AADRA2AADRA2BADRA2C
SCHEMBL5326988 0.86 DRD2 (0.39) DRD2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL5332019 0.78 DRD2 (0.43) DRD2DRD3TSHRDRD4SIGMAR1
SCHEMBL14387115 0.78 DRD2 (0.43) DRD2DRD3TSHRDRD4SIGMAR1
SCHEMBL5325882 0.78 CCR1 (0.36) ADRA2ACHRM1CHRM3ADRA1BSIGMAR1
SCHEMBL5351797 0.78 DRD2 (0.37) DRD2TACR1
SCHEMBL5350156 0.77 HTR1D (0.46) DRD2HTR1ASLC6A4OPRM1CHRM2
SCHEMBL5326187 0.77 USP2 (0.41) DRD2SIGMAR1LMNA
SCHEMBL5325741 0.76 DRD2 (0.40) DRD2MC4R

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 DRD2 284/4885HTR1A 1112/4885ADRA2A 417/4885

“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.