SCHEMBL6750346

SCHEMBL6750346

COC(=O)C1C2CCCC1CN(C)C2

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.40
PPM1B O75688 1/20 0.38
PTPN1 P18031 1/20 0.38
PPP1CC P36873 1/20 0.38
BRD4 O60885 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL19013690 0.92 CYP2C19 (0.42) CYP2C19PPM1BPTPN1PPP1CCBRD4
SCHEMBL22723424 0.79 MEN1 (0.46) CYP2C19PPM1BPTPN1PPP1CC
SCHEMBL8319934 0.78 ALDH1A1 (0.37) TP53
SCHEMBL20306770 0.77 MEN1 (0.47) CYP2C19PPM1BPTPN1PPP1CC
SCHEMBL30461703 0.75 CYP2C19 (0.45) CYP2C19PPM1BPTPN1PPP1CCBRD4
SCHEMBL16920613 0.74 CHRNB2 (0.55) PPM1BPTPN1PPP1CCTP53
SCHEMBL17322742 0.72 CHRNB2 (0.57) BRD4TP53
SCHEMBL20682325 0.72 CYP2C19 (0.39) CYP2C19PPM1BPTPN1PPP1CCTP53
SCHEMBL21987247 0.72 TP53 (0.56) CYP2C19PPM1BPTPN1PPP1CCTP53
SCHEMBL19013663 0.72 CYP2C19 (0.38) CYP2C19PPM1BPTPN1PPP1CCTP53

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 2 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

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 CYP2C19 61/4885PPM1B 1280/4885PTPN1 1423/4885

“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.