SCHEMBL6747682

SCHEMBL6747682

CCOC(=O)c1ccc(OCCC2[C@@H]3CCC[C@H]2CN(C)C3)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.52
KCNH2 Q12809 1/20 0.52
TBXAS1 P24557 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 1/20 0.43
CYP2C9 P11712 1/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
SCN1A P35498 1/20 0.43
SCN2A Q99250 1/20 0.43
SCN3A Q9NY46 1/20 0.43
HRH2 P25021 2/20 0.42
HRH1 P35367 2/20 0.42

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
SCHEMBL6747683 1.00 HRH3 (0.52) HRH3KCNH2TBXAS1TDP1L3MBTL1
SCHEMBL8318003 0.77 KDM1A (0.45) HRH3ALDH1A1
SCHEMBL6747214 0.77 KDM1A (0.45) HRH3ALDH1A1
SCHEMBL7317389 0.77 KCNH2 (0.56) HRH3KCNH2TBXAS1TDP1L3MBTL1
SCHEMBL6701399 0.74 TDP1 (0.74) HRH3KCNH2TBXAS1TDP1L3MBTL1
SCHEMBL1373303 0.74 HRH3 (0.70) HRH3KCNH2SCN1ASCN2ASCN3A
SCHEMBL3614846 0.74 HRH3 (0.70) HRH3KCNH2SCN1ASCN2ASCN3A
SCHEMBL9385244 0.73 TDP1 (0.54) HRH3KCNH2TBXAS1TDP1L3MBTL1
SCHEMBL21408538 0.73 HRH3 (0.79) HRH3KCNH2L3MBTL1HPGDCYP2C9
SCHEMBL22048754 0.72 KCNH2 (0.57) HRH3KCNH2TBXAS1TDP1L3MBTL1

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 HRH3 12/4885KCNH2 762/4885TBXAS1 80/4885

“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.