SCHEMBL5705202

SCHEMBL5705202

Cn1cc(C2CCN(CCCCCCCNC(=O)OC(C)(C)C)CC2)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.54
CCR2 P41597 4/20 0.48
CNR2 P34972 1/20 0.47
SIGMAR1 Q99720 2/20 0.46
GAA P10253 1/20 0.46
PIM1 P11309 1/20 0.45
PIM3 Q86V86 1/20 0.45
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44

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
SCHEMBL6133804 0.88 SIGMAR1 (0.51) DRD2CNR2SIGMAR1PIM1PIM3
SCHEMBL5705015 0.83 DRD2 (0.49) DRD2CCR2GAA
SCHEMBL6135265 0.83 DRD2 (0.49) DRD2CCR2GAA
SCHEMBL6133832 0.82 CCR2 (0.66) CCR2
SCHEMBL7389659 0.81 BCHE (0.57) DRD2
SCHEMBL6848950 0.81 DRD2 (0.55) DRD2CNR2SIGMAR1JAK2JAK1
SCHEMBL7383393 0.80 BCHE (0.58) DRD2
SCHEMBL7384300 0.79 BCHE (0.56) DRD2
SCHEMBL7384301 0.79 BCHE (0.56) DRD2
SCHEMBL7382653 0.79 BCHE (0.56) DRD2

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
EP-1691807-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF BONE DISEASES Astellas Pharma Inc. (JP) 2006-08-23 EP disclosed
US-20050245540-A1 New methods FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
WO-2005056012-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF BONE DISEASES ASTELLAS PHARMA INC. (JP) 2005-06-23 WO 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-20050245540-A1 New methods TGFB1, TGFBR1, TGFB2 DRD2 2595/4885CCR2 637/4885CNR2 613/4885

“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.