SCHEMBL5576084

SCHEMBL5576084

CC(C)(C)OC(=O)N1CCC(N2C(=O)N(C3CCCCC3)C[C@H]2c2cccc(Cl)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 17/20 0.54
STS P08842 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
CCR4 P51679 1/20 0.45
KCNH2 Q12809 1/20 0.45

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
SCHEMBL5576089 1.00 CCR5 (0.54) CCR5STSTP53MAPTCCR4
SCHEMBL5572449 0.92 CCR5 (0.47) CCR5STSTP53MAPTCCR4
SCHEMBL4608051 0.92 CCR5 (0.46) CCR5STSTP53MAPTCCR4
SCHEMBL5572456 0.86 STS (0.48) CCR5STSTP53MAPT
SCHEMBL4597857 0.86 CCR5 (0.57) CCR5CCR4KCNH2
SCHEMBL4625809 0.83 STS (0.45) STSTP53MAPT
SCHEMBL4597776 0.82 TP53 (0.47) STSTP53MAPT
SCHEMBL4595920 0.81 STS (0.44) CCR5STSTP53MAPT
SCHEMBL5572558 0.81 GPR119 (0.47) CCR5TP53MAPT
SCHEMBL5572556 0.81 GPR119 (0.47) CCR5TP53MAPT

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 1 patent. 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

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 1/4885STS 4841/4885TP53 2854/4885

“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.