SCHEMBL4754524

SCHEMBL4754524

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

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 1/20 0.41
ALDH1A1 P00352 2/20 0.37
NPC1 O15118 1/20 0.37
SMO Q99835 2/20 0.32
FAAH O00519 1/20 0.32
DPP4 P27487 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDK2 Q15119 2/20 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
SCHEMBL17083745 0.88 FAAH (0.40) CYP3A4ALDH1A1NPC1FAAHDPP4
SCHEMBL584795 0.79 GNAI3 (0.50) NAMPTCYP3A4CYP2C9ALDH1A1NPC1
SCHEMBL22919353 0.78 EPHX2 (0.49) ALDH1A1NPC1
SCHEMBL14009820 0.77 NAMPT (0.42) NAMPTCYP3A4CYP2C9ALDH1A1NPC1
SCHEMBL5010502 0.77 NAMPT (0.38) NAMPTPDK2
SCHEMBL21888398 0.76 HCRTR2 (0.43) NAMPTCYP3A4CYP2C9ALDH1A1NPC1
SCHEMBL4754522 0.76 NAMPT (0.44) NAMPTCYP3A4CYP2C9ALDH1A1NPC1
SCHEMBL4754539 0.76 ALDH1A1 (0.38) NAMPTALDH1A1NPC1SMN1; SMN2
SCHEMBL8487332 0.75 ATM (0.48) NAMPTCYP3A4CYP2C9ALDH1A1DPP4
SCHEMBL7292087 0.75 NPC1 (0.47) NAMPTALDH1A1NPC1

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 NAMPT 4382/4885CYP3A4 3670/4885CYP2C9 3831/4885

“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.