SCHEMBL6358683

SCHEMBL6358683

Clc1cccc(Cn2nnnc2-c2cccc(Cl)c2Cl)c1Cl

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 19/20 0.80
TRPA1 O75762 1/20 0.64
SIGMAR1 Q99720 1/20 0.64
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47

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
SCHEMBL5815194 0.93 P2RX7 (0.82) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL5814515 0.89 P2RX7 (1.00) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL5917658 0.88 P2RX7 (0.75) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL5917648 0.88 P2RX7 (0.75) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL5812970 0.88 P2RX7 (0.75) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL5917667 0.88 P2RX7 (0.75) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL6362759 0.88 P2RX7 (0.75) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL6355284 0.88 P2RX7 (0.75) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL5817555 0.87 P2RX7 (1.00) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4
SCHEMBL5815022 0.86 P2RX7 (1.00) P2RX7TRPA1SIGMAR1SLC6A2SLC6A4

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-20050009812-A1 Remedies for stress diseases comprising mitochondrial benzodiazepine receptor antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 2005-01-13 US claimed
EP-1438973-A1 REMEDIES FOR STRESS DISEASES COMPRISING MITOCHONDRIAL BENZODIAZEPINE RECEPTOR ANTAGONISTS ONO PHARMACEUTICAL CO., LTD. (JP) 2004-07-21 EP claimed
US-20050009812-A1 Remedies for stress diseases comprising mitochondrial benzodiazepine receptor antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 2005-01-13 US disclosed
EP-1438973-A1 REMEDIES FOR STRESS DISEASES COMPRISING MITOCHONDRIAL BENZODIAZEPINE RECEPTOR ANTAGONISTS ONO PHARMACEUTICAL CO., LTD. (JP) 2004-07-21 EP 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-20050009812-A1 Remedies for stress diseases comprising mitochondrial benzodiazepine receptor antagonists TFAM, CYP11B2, CYP11B1 P2RX7 448/4885TRPA1 708/4885SIGMAR1 341/4885

“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.