SCHEMBL4756879

SCHEMBL4756879

CC(C)N1CCC([C]=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.36
KCNH2 Q12809 3/20 0.36
CYP2D6 P10635 2/20 0.36
ALDH1A1 P00352 1/20 0.34
CHRNA7 P36544 1/20 0.32
KDM1A O60341 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
SCHEMBL8405492 0.76 DRD2 (0.37)
SCHEMBL1569825 0.76 HRH3 (0.39) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL2738325 0.75 HRH3 (0.36) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL104775 0.75 HRH3 (0.43) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL24789555 0.74 CHRNA7 (0.39) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL24734655 0.74 CHRNA7 (0.39) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL24733191 0.74 CHRNA7 (0.39) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL475277 0.74
SCHEMBL24733229 0.74 CHRNA7 (0.39) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL27322457 0.73 HRH3 (0.39) HRH3KCNH2CYP2D6ALDH1A1CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008133344-A2 PIPERIDINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 WO claimed
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 US claimed
WO-2008133344-A2 PIPERIDINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 WO disclosed
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 HRH3 43/4885KCNH2 48/4885CYP2D6 3856/4885

“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.