SCHEMBL23745899

SCHEMBL23745899

CC(C)(C)OC(=O)NCCC1CN(C(=O)c2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 6/20 0.53
TLR1 Q15399 6/20 0.53
NAMPT P43490 4/20 0.51
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
ACACB O00763 1/20 0.45
ACACA Q13085 1/20 0.45
NPC1L1 Q9UHC9 2/20 0.44
RBP4 P02753 1/20 0.44
SIGMAR1 Q99720 2/20 0.44
CNR2 P34972 1/20 0.44
CHRNB2 P17787 1/20 0.44
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CHRNA7 P36544 1/20 0.44
CHRNA4 P43681 1/20 0.44

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
SCHEMBL13737768 0.92 NAMPT (0.62) TLR2TLR1NAMPTNPC1L1SIGMAR1
SCHEMBL13738400 0.83 NAMPT (0.59) TLR2TLR1NAMPTKDM4EPKM
SCHEMBL3285436 0.81 PKM (0.61) NAMPTKDM4EPKMACACBACACA
SCHEMBL5969167 0.80 MEN1 (0.43) NAMPTSIGMAR1CNR2
SCHEMBL8298895 0.78 NAMPT (0.54) TLR2TLR1NAMPTNPC1L1RBP4
SCHEMBL5968986 0.77 SYK (0.47) NAMPTSIGMAR1
SCHEMBL24392263 0.77 NAMPT (0.51) NAMPTKDM4EPKM
SCHEMBL4703208 0.77 CHRM4 (0.56) KDM4EPKMACACBACACA
SCHEMBL9144556 0.76 HTT (0.51) KDM4EPKMSIGMAR1
SCHEMBL9270099 0.75 TLR2 (0.48) TLR2TLR1NAMPTRBP4CHRNB2

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-20210246147-A1 PIPERIDINE DERIVATIVES AND COMPOSITIONS FOR THE INHIBITION OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) Valo Health, LLC 2021-08-12 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-20210246147-A1 PIPERIDINE DERIVATIVES AND COMPOSITIONS FOR THE INHIBITION OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) NAMPT, NAPRT, NNMT TLR2 3145/4885TLR1 2589/4885NAMPT 1/4885

“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.