SCHEMBL5322912

SCHEMBL5322912

CCOC(=O)C(Br)CC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
RECQL P46063 1/20 0.42
EPHX1 P07099 1/20 0.42
NR1H2 P55055 1/20 0.42
GPR119 Q8TDV5 6/20 0.41
DPP4 P27487 1/20 0.41
GAA P10253 1/20 0.41
FAAH O00519 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL21559819 0.88 KDM4E (0.47) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL21552103 0.88 KDM4E (0.47) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL7350839 0.86 HPGD (0.46) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL21564360 0.85 HPGD (0.45) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL31082333 0.85 HPGD (0.45) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL4596204 0.85 HPGD (0.45) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL9324542 0.85 GPR119 (0.47) HPGDKDM4EPKMNR1H2GPR119
SCHEMBL23850573 0.84 DPP4 (0.46) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL1693314 0.84 DPP4 (0.46) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL27572929 0.84 DPP4 (0.44) HPGDKDM4EPKMRECQLEPHX1

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
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
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 HPGD 610/4885KDM4E 3992/4885PKM 3627/4885

“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.