SCHEMBL6749048

SCHEMBL6749048

COC(=N)C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.57
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ TSHR P16473 1/20 0.54
▸ ABL1 P00519 1/20 0.53
▸ RIN1 Q13671 1/20 0.53
▸ CXCR4 P61073 1/20 0.52
▸ CCR3 P51677 1/20 0.51
▸ BCHE P06276 1/20 0.51
▸ BACE1 P56817 1/20 0.51
▸ POLB P06746 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
Hydrochloric Acid SCHEMBL6749089 0.98 ACHE (0.55) ACHEMEN1KMT2ATSHRABL1
Hydrochloric Acid SCHEMBL311655 0.98 ACHE (0.55) ACHEMEN1KMT2ATSHRABL1
SCHEMBL2794872 0.82 ALDH1A1 (0.63) MEN1KMT2ATSHRABL1RIN1
SCHEMBL1135840 0.80 MEN1 (0.57) ACHEMEN1KMT2ATSHRABL1
Hydrochloric Acid SCHEMBL9536512 0.78 CXCR4 (0.59) ACHECXCR4CCR3BCHEBACE1
Hydrochloric Acid SCHEMBL310978 0.78 MEN1 (0.56) ACHEMEN1KMT2ATSHRABL1
SCHEMBL1717074 0.77 LTA4H (0.63) MEN1KMT2ATSHRABL1RIN1
SCHEMBL22483452 0.77 MEN1 (0.58) ACHEMEN1KMT2ATSHRABL1
SCHEMBL8263431 0.77 LTA4H (0.63) MEN1KMT2ATSHRABL1RIN1
SCHEMBL592839 0.76 MEN1 (0.66) ACHEMEN1KMT2ATSHRABL1

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 ACHE 2066/4885MEN1 4580/4885KMT2A 3395/4885

“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.

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