SCHEMBL7126699

SCHEMBL7126699

O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2)c1ccc(Sc2ccc(Cl)s2)cc1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.36
F10 P00742 16/20 0.36
F2 P00734 3/20 0.36
TRPV1 Q8NER1 1/20 0.35
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL7124223 0.87 CHRNA7 (0.36) CHRNA7F10SLC6A2SLC6A4SLC6A3
SCHEMBL7121696 0.85 CHRNA7 (0.35) CHRNA7F10SLC6A2SLC6A4SLC6A3
SCHEMBL7224323 0.85 MEN1 (0.38) F10F2
SCHEMBL7124013 0.85 EPHX2 (0.36) CHRNA7SLC6A2SLC6A4SLC6A3
SCHEMBL7127427 0.85 F10 (0.38) CHRNA7F10TRPV1SLC6A2SLC6A4
SCHEMBL7125381 0.85 CHRNA7 (0.35) CHRNA7SLC6A2SLC6A4SLC6A3
SCHEMBL7120663 0.85 SLC6A2 (0.38) CHRNA7SLC6A2SLC6A4SLC6A3
SCHEMBL7123508 0.84 TRPV1 (0.44) CHRNA7F10TRPV1SLC6A4SLC6A3
SCHEMBL7113625 0.84 CHRNA7 (0.36) CHRNA7TRPV1SLC6A2SLC6A4SLC6A3
SCHEMBL7120734 0.84 GAA (0.35) CHRNA7SLC6A2SLC6A4SLC6A3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-04-10 US claimed
US-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-04-10 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-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease CYP7B1, UGT2B7, CYP1B1 CHRNA7 397/4885F10 4216/4885F2 4147/4885

“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.