SCHEMBL5811097

SCHEMBL5811097

Cc1ccccc1Cn1nnnc1-c1cccc(Cl)c1F

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 18/20 0.77
TRPA1 O75762 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
IDO1 P14902 1/20 0.44
TDO2 P48775 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
SCHEMBL6356183 0.88 P2RX7 (0.82) P2RX7TRPA1SIGMAR1IDO1TDO2
SCHEMBL5801683 0.87 P2RX7 (0.71) P2RX7IDO1TDO2
SCHEMBL5814515 0.87 P2RX7 (1.00) P2RX7TRPA1SIGMAR1IDO1TDO2
SCHEMBL5802163 0.84 P2RX7 (0.67) P2RX7IDO1TDO2
SCHEMBL5815683 0.82 P2RX7 (0.81) P2RX7IDO1TDO2
SCHEMBL5813093 0.81 P2RX7 (1.00) P2RX7TRPA1SIGMAR1IDO1TDO2
SCHEMBL6356890 0.80 P2RX7 (0.62) P2RX7TRPA1SIGMAR1
SCHEMBL5812970 0.79 P2RX7 (0.75) P2RX7TRPA1SIGMAR1
SCHEMBL5813903 0.78 P2RX7 (0.67) P2RX7TRPA1SIGMAR1
SCHEMBL5815194 0.78 P2RX7 (0.82) P2RX7TRPA1SIGMAR1

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
US-20060211739-A1 Use of selective P2X7 receptor antagonists ABBOTT LABORATORIES 2006-09-21 US claimed
WO-2006086229-A1 THE USE OF SELECTIVE P2X7 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2006-08-17 WO claimed
US-20060211739-A1 Use of selective P2X7 receptor antagonists ABBOTT LABORATORIES 2006-09-21 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-20060211739-A1 Use of selective P2X7 receptor antagonists P2RX1, P2RX3, P2RX7 P2RX7 3/4885TRPA1 31/4885SIGMAR1 63/4885

“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.