SCHEMBL6745787

SCHEMBL6745787

CCOC(=O)C(C)(C)CC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.56
ACHE P22303 8/20 0.55
BCHE P06276 4/20 0.55
MAOB P27338 1/20 0.51
OPRM1 P35372 1/20 0.50

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
SCHEMBL7501397 0.86 CHRM3 (0.54) CHRM3ACHEBCHEMAOB
SCHEMBL6749692 0.82 OPRM1 (0.54) CHRM3ACHEBCHEOPRM1
SCHEMBL9218378 0.80 ACHE (0.64) CHRM3ACHEBCHE
SCHEMBL8809184 0.80 DRD2 (0.61) ACHEBCHEMAOB
Hydrochloric Acid SCHEMBL7684853 0.79 OPRM1 (0.50) CHRM3ACHEBCHEOPRM1
Hydrochloric Acid SCHEMBL9536536 0.79 DRD2 (0.60) ACHEBCHE
SCHEMBL803462 0.78 CCR3 (0.67) ACHEBCHE
SCHEMBL18458295 0.78 SIGMAR1 (0.56) OPRM1
SCHEMBL9213124 0.78 MEN1 (0.52) CHRM3ACHEBCHEOPRM1
Hydrochloric Acid SCHEMBL9217805 0.77 MEN1 (0.51) CHRM3ACHEBCHEOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092737-A1 Benzopiperidine derivatives EISAI CO., LTD. 2004-05-13 US disclosed
US-6518423-B1 These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and EISAI CO., LTD. (JP) 2003-02-11 US disclosed
EP-0934941-A1 BENZOPIPERIDINE DERIVATIVES Eisai Co., Ltd. (JP) 1999-08-11 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-20040092737-A1 Benzopiperidine derivatives HLA-DRB1, HRH1, HRH2 CHRM3 1616/4885ACHE 2066/4885BCHE 421/4885

“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.