SCHEMBL5525314

SCHEMBL5525314

Cc1c(C(=O)N2CC3CN(CC[CH]c4cccc(F)c4)C[C@H]3C2)c(C(N)=O)cc(=O)n1C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 13/20 0.39
CCL5 P13501 4/20 0.39
KCNH2 Q12809 1/20 0.39
HCRTR2 O43614 5/20 0.38
HCRTR1 O43613 4/20 0.38

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
SCHEMBL4935264 0.91 CCR5 (0.39) CCR5CCL5
SCHEMBL4691489 0.85 CCR5 (0.43) CCR5CCL5KCNH2HCRTR2HCRTR1
SCHEMBL4696229 0.85 CCR5 (0.42) CCR5CCL5KCNH2HCRTR2HCRTR1
SCHEMBL4969362 0.82 CCR5 (0.48) CCR5CCL5KCNH2HCRTR2HCRTR1
SCHEMBL4697962 0.81 CCR5 (0.43) CCR5CCL5KCNH2HCRTR2HCRTR1
SCHEMBL5660545 0.80 CCR5 (0.41) CCR5CCL5
SCHEMBL4693713 0.80 CCR5 (0.49) CCR5CCL5HCRTR2HCRTR1
SCHEMBL4693570 0.79 CCR5 (0.52) CCR5CCL5KCNH2
SCHEMBL3286468 0.79 CCR5 (0.52) CCR5CCL5KCNH2
SCHEMBL5662861 0.79 CCR5 (0.38) CCR5CCL5

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-20070191406-A1 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC 2007-08-16 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-20070191406-A1 Heterocyclic antiviral compounds CCR5, CX3CR1, CXCR1 CCR5 1/4885CCL5 14/4885KCNH2 1746/4885

“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.