SCHEMBL6747160

SCHEMBL6747160

CC(=O)N1c2cc(C=O)ccc2Sc2nccnc21

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.37
HDAC6 Q9UBN7 1/20 0.35
ICAM1 P05362 2/20 0.34
LMNA P02545 2/20 0.33
PKM P14618 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.31
SNCA P37840 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL6745642 0.86 BCHE (0.41) HDAC6LMNAALDH1A1HPGD
SCHEMBL9832621 0.80 NOX1 (0.61) NOX1HDAC6SNCA
SCHEMBL9830999 0.73 SNCA (0.54) NOX1LMNAPKMNPSR1ALDH1A1
SCHEMBL6745827 0.73 HDAC6 (0.36) NOX1HDAC6ICAM1LMNAPKM
SCHEMBL6747220 0.68 BCHE (0.38) HDAC6
SCHEMBL6747218 0.68 TTR (0.42) LMNAHPGD
SCHEMBL25141285 0.67 LMNA (0.50) NOX1HDAC6LMNANPSR1ALDH1A1
SCHEMBL25141320 0.67 BCHE (0.51) NOX1LMNAALDH1A1
SCHEMBL9832954 0.66 BCHE (0.64) NOX1HDAC6LMNANPSR1HPGD
SCHEMBL6749150 0.66 LMNA (0.52) NOX1HDAC6ICAM1LMNAALDH1A1

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 NOX1 2806/4885HDAC6 1953/4885ICAM1 412/4885

“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.