SCHEMBL6747374

SCHEMBL6747374

CCOC(=O)CCc1ccc2c(c1)N(COC)c1nccnc1S2

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
P2RY12 Q9H244 1/20 0.38
SYK P43405 9/20 0.37
CYP4Z1 Q86W10 1/20 0.34
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL6746519 0.83 HDAC6 (0.40) HDAC6
SCHEMBL6747454 0.82 HDAC6 (0.43) HDAC6
SCHEMBL6751862 0.81 HDAC6 (0.39) CYP4A11HDAC6
SCHEMBL6749064 0.81 HDAC6 (0.41) HDAC6
SCHEMBL6745700 0.80 HDAC6 (0.37) HDAC6
SCHEMBL6746539 0.79 HDAC6 (0.41) HDAC6
SCHEMBL6745492 0.79 HDAC6 (0.40) HDAC6
SCHEMBL6749235 0.79 HDAC6 (0.36) HDAC6
SCHEMBL6749359 0.78 HDAC6 (0.36) HDAC6
SCHEMBL8315505 0.78 HDAC6 (0.45) HDAC6

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 CYP4F2 264/4885CYP4A11 131/4885HDAC6 1953/4885

“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.