SCHEMBL5809694

SCHEMBL5809694

COc1cccc(-c2nnnn2Cc2ccccc2Cl)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 15/20 1.00
LMNA P02545 1/20 0.48
KCNN4 O15554 1/20 0.47
TP53 P04637 2/20 0.44
HSD11B1 P28845 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 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
SCHEMBL6361640 0.90 P2RX7 (0.82) P2RX7LMNAKCNN4HSD11B1
SCHEMBL5815997 0.85 P2RX7 (0.74) P2RX7KCNN4HSD11B1
SCHEMBL5813903 0.81 P2RX7 (0.67) P2RX7LMNAALDH1A1
SCHEMBL5815194 0.80 P2RX7 (0.82) P2RX7
SCHEMBL6357728 0.76 P2RX7 (0.76) P2RX7KCNN4HSD11B1
SCHEMBL6358726 0.76 P2RX7 (0.61) P2RX7LMNAKCNN4HSD11B1ALDH1A1
SCHEMBL6357904 0.76 P2RX7 (0.61) P2RX7KCNN4
SCHEMBL6360823 0.76 P2RX7 (0.61) P2RX7LMNATP53HSD11B1ALDH1A1
SCHEMBL6356718 0.75 P2RX7 (0.60) P2RX7LMNATP53
SCHEMBL6361632 0.75 P2RX7 (0.63) P2RX7

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 4 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
WO-2006086229-A1 THE USE OF SELECTIVE P2X7 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2006-08-17 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-20060211739-A1 Use of selective P2X7 receptor antagonists P2RX1, P2RX3, P2RX7 P2RX7 3/4885LMNA 3709/4885KCNN4 818/4885

“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.