SCHEMBL5006473

SCHEMBL5006473

CCOC(=O)C1CCN(C)CC1c1ccccc1C

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ MAPT P10636 2/20 0.44
▸ PKM P14618 1/20 0.44
▸ SLC6A2 P23975 2/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ SLC6A3 Q01959 2/20 0.44
▸ SSTR1 P30872 1/20 0.42
▸ SSTR4 P31391 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL4094243 0.85 SLC6A3 (0.59) MAPTPKMSLC6A2SLC6A4SLC6A3
SCHEMBL4754551 0.82 GPR119 (0.44) ALDH1A1MAPTPKMKDM4E
SCHEMBL6082005 0.78 TSHR (0.49) ALDH1A1SMN1; SMN2MAPTPKMHTT
SCHEMBL4757346 0.78 MAPT (0.46) ALDH1A1MAPTPKMSLC6A2SLC6A4
SCHEMBL6829116 0.77 SLC6A3 (0.74) SLC6A2SLC6A4SLC6A3
SCHEMBL10839544 0.77 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3
SCHEMBL4757240 0.77 CHRM2 (0.45) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL2508884 0.76 MAPT (0.47) ALDH1A1SMN1; SMN2MAPTPKMHTT
SCHEMBL1896746 0.76 USP30 (0.51) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL21865774 0.75 MAPT (0.41) ALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 — — 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-20080275085-A1 Piperidine derivative and use thereof TACR2, TACR1, PRLHR ALDH1A1 3412/4885SMN1; SMN2 4526/4885MAPT 4330/4885

“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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