SCHEMBL7127517

SCHEMBL7127517

CC(=O)Nc1coc(Sc2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4)cc2)n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 2/20 0.34
CHRNA7 P36544 1/20 0.33
EZH2 Q15910 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL7120674 0.87 CHRNA7 (0.34) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7115016 0.87 CHRNA7 (0.35) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7124949 0.85 CHRNA7 (0.35) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7124189 0.84 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7121241 0.83 EPHX2 (0.35) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7117047 0.82 HDAC6 (0.36) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7113509 0.82 CHRNA7 (0.33) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7124198 0.82 HDAC4 (0.34) SLC6A2SLC6A4SLC6A3CHRNA7
SCHEMBL7117025 0.82 CHRNA7 (0.33) SLC6A2SLC6A4SLC6A3CHRNA7EZH2
SCHEMBL7116049 0.82 CHRNA7 (0.35) SLC6A2SLC6A4SLC6A3CHRNA7EZH2

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 SLC6A2 1156/4885SLC6A4 2137/4885SLC6A3 2265/4885

“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.