SCHEMBL6098732

SCHEMBL6098732

COc1cccc2ccc(C(=O)N[C@@H]3C[C@H]4CCN(C4)C3)cc12

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 9/20 0.55
MCHR1 Q99705 4/20 0.46
DRD4 P21917 2/20 0.44
DRD2 P14416 1/20 0.44
DRD3 P35462 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
SCHEMBL6098737 1.00 CHRNA7 (0.55) CHRNA7MCHR1DRD4DRD2DRD3
SCHEMBL6100493 0.95 CHRNA7 (0.48) CHRNA7MCHR1DRD4DRD2DRD3
SCHEMBL6101199 0.92 CHRNA7 (0.58) CHRNA7MCHR1DRD4DRD2DRD3
SCHEMBL6101207 0.92 CHRNA7 (0.58) CHRNA7MCHR1DRD4DRD2DRD3
SCHEMBL6637254 0.92 CHRNA7 (0.58) CHRNA7MCHR1DRD4DRD2DRD3
SCHEMBL6100035 0.87 CHRNA7 (0.51) CHRNA7MCHR1DRD4DRD2DRD3
SCHEMBL6099981 0.84 CHRNA7 (0.64) CHRNA7DRD4
SCHEMBL6099976 0.84 CHRNA7 (0.64) CHRNA7DRD4
SCHEMBL6099145 0.83 CHRNA7 (0.60) CHRNA7DRD2DRD3
SCHEMBL6099150 0.83 CHRNA7 (0.60) CHRNA7DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7001900-B2 Azabicyclic compounds for the treatment of disease PFIZER INC. (US) 2006-02-21 US claimed
US-20030236270-A1 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
US-7001900-B2 Azabicyclic compounds for the treatment of disease PFIZER INC. (US) 2006-02-21 US disclosed
EP-1478646-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP disclosed
US-20030236270-A1 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US disclosed
WO-2003072578-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 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-20030236270-A1 Azabicyclic compounds for the treatment of disease MALT1, TPMT, CYP2B6 CHRNA7 1836/4885MCHR1 2283/4885DRD4 2751/4885

“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.