SCHEMBL6847680

SCHEMBL6847680

COCN1c2cc(CN3CCCC(CO[Si](C)(C)C(C)(C)C)C3)ccc2Sc2nccnc21

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 11/20 0.37
MAOA P21397 6/20 0.34
MAOB P27338 6/20 0.34
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ACHE P22303 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
SCHEMBL6857064 0.87 MAPT (0.43) ICAM1MAOAMAOB
SCHEMBL6842033 0.76 ICAM1 (0.36) ICAM1MAOAMAOBACHE
Hydrochloric Acid SCHEMBL6747679 0.73 HDAC6 (0.32)
SCHEMBL6746539 0.71 HDAC6 (0.41) ICAM1
SCHEMBL20037696 0.70 CD274 (0.39) MAOAMAOBNPSR1ACHE
SCHEMBL6751994 0.70 ICAM1 (0.34) ICAM1
SCHEMBL6750151 0.70 HDAC6 (0.40) ICAM1
SCHEMBL6747458 0.70 HDAC6 (0.40) ICAM1NPSR1
SCHEMBL6747454 0.69 HDAC6 (0.43) ICAM1NPSR1
SCHEMBL6745700 0.69 HDAC6 (0.37)

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 ICAM1 412/4885MAOA 2191/4885MAOB 1926/4885

“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.