SCHEMBL5575772

SCHEMBL5575772

O=C1CCN(C(=O)c2ccc(CN3CCC(N4C(=O)N(C5CCCCC5)C[C@H]4c4ccccc4)CC3)cc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 19/20 0.72
CHRM2 P08172 1/20 0.52
CHRM3 P20309 1/20 0.52
CCR4 P51679 1/20 0.52

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
SCHEMBL5575780 1.00 CCR5 (0.72) CCR5CHRM2CHRM3CCR4
SCHEMBL4609356 0.91 CCR5 (0.72) CCR5CHRM2CHRM3CCR4
SCHEMBL4609349 0.91 CCR5 (0.72) CCR5CHRM2CHRM3CCR4
SCHEMBL5575568 0.90 CCR5 (0.71) CCR5CHRM2CHRM3CCR4
SCHEMBL4597511 0.90 CCR5 (0.71) CCR5CHRM2CHRM3CCR4
SCHEMBL4598154 0.90 CCR5 (0.71) CCR5CHRM2CHRM3CCR4
SCHEMBL5575506 0.90 CCR5 (0.71) CCR5CHRM2CHRM3CCR4
SCHEMBL4596214 0.88 CCR5 (0.89) CCR5CHRM2CHRM3CCR4
SCHEMBL4609992 0.88 CCR5 (0.89) CCR5CHRM2CHRM3CCR4
SCHEMBL5575531 0.87 CCR5 (0.71) CCR5CCR4

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
US-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 US disclosed
WO-2007022371-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORPORATION (US) 2007-02-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 CCR5 1/4885CHRM2 1961/4885CHRM3 387/4885

“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.