SCHEMBL13627848

SCHEMBL13627848

COC(=O)N1CCC(C(=O)NCCCO)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.47
GAA P10253 3/20 0.46
KDM4C Q9H3R0 1/20 0.46
LMNA P02545 3/20 0.46
HSD17B10 Q99714 2/20 0.46
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
KMT2A Q03164 2/20 0.44
HTT P42858 2/20 0.43
USP2 O75604 1/20 0.43
GNAI3 P08754 1/20 0.43
GNAO1 P09471 1/20 0.43
GNAI1 P63096 1/20 0.43

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
SCHEMBL13627843 0.91 LMNA (0.51) CYP3A4TSHRGAAKDM4CLMNA
SCHEMBL13637441 0.88 CYP3A4 (0.50) CYP3A4TSHRGAAKDM4CLMNA
SCHEMBL13637538 0.87 CYP3A4 (0.49) CYP3A4TSHRGAAKDM4CLMNA
SCHEMBL13627855 0.87 CYP3A4 (0.67) CYP3A4TSHRGAAKDM4CLMNA
SCHEMBL13627841 0.84 CYP3A4 (0.47) CYP3A4TSHRGAAKDM4CLMNA
SCHEMBL19840511 0.83 HPGD (0.51) ALDH1A1HPGDKMT2A
SCHEMBL13451443 0.83 CYP3A4 (0.52) CYP3A4TSHRGAAKDM4CLMNA
SCHEMBL19840507 0.82 TDP1 (0.52) ALDH1A1HPGDKMT2A
SCHEMBL3436777 0.81 GNAI3 (0.50) CYP3A4TSHRGAALMNAHSD17B10
SCHEMBL13627850 0.81 HSD17B10 (0.45) CYP3A4TSHRGAAKDM4CHSD17B10

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
EP-2022782-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE PIPERIDINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2009-02-11 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-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS SNCA, SYNJ1, KCNH2 CYP3A4 3249/4885TSHR 2873/4885GAA 778/4885

“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.