SCHEMBL1147154

SCHEMBL1147154

CN(C(=O)C1(O)CCNCC1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 3/20 0.43
MMP9 P14780 3/20 0.43
MMP8 P22894 3/20 0.43
MMP13 P45452 2/20 0.43
MMP1 P03956 1/20 0.43
MMP14 P50281 1/20 0.43
SLC6A4 P31645 7/20 0.41
SLC6A3 Q01959 6/20 0.41
EPHX1 P07099 1/20 0.40
MMP10 P09238 2/20 0.39
KCNH2 Q12809 2/20 0.39
SLC6A2 P23975 1/20 0.38
PDE2A O00408 1/20 0.38
LIPE Q05469 1/20 0.38
MMP2 P08253 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
OPRD1 P41143 1/20 0.38

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
SCHEMBL1147510 0.85 MMP3 (0.42) MMP3MMP9MMP8MMP13MMP1
SCHEMBL30937201 0.77 SLC6A4 (0.40) MMP9MMP8MMP13SLC6A4SLC6A3
SCHEMBL1147209 0.76 CHRM4 (0.48) LIPETSHRP2RY1
SCHEMBL1147095 0.76 EPHX2 (0.52) EPHX1LIPEMEN1KMT2AEPHX2
SCHEMBL1146732 0.76 PTH1R (0.41) MMP9MMP8MMP13MMP14SLC6A4
SCHEMBL1147320 0.74 LIPE (0.47) MMP13EPHX1LIPEMMP2MEN1
SCHEMBL1147159 0.74 ALDH1A1 (0.43) MEN1KMT2A
SCHEMBL1145512 0.74 EPHX1 (0.56) MMP3MMP9MMP8MMP13MMP1
SCHEMBL1147123 0.73 LIPE (0.57) MMP13EPHX1LIPEMMP2MEN1
SCHEMBL1147411 0.73 OPRM1 (0.43) MEN1TSHRKMT2AP2RY1GPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2480532-B1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS HOFFMANN LA ROCHE (CH) 2013-11-20 EP disclosed
US-8399676-B2 Piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-8399676-B2 Piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-8399676-B2 Piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
EP-2480532-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. Hoffmann-La Roche AG (CH) 2012-08-01 EP disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
WO-2011012602-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. HOFFMANN-LA ROCHE AG (CH) 2011-02-03 WO disclosed
WO-2011012602-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. HOFFMANN-LA ROCHE AG (CH) 2011-02-03 WO 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-20110028515-A1 NEW PIPERIDINE DERIVATIVES ADRA1D, ADORA1, H1-0 MMP3 2953/4885MMP9 4018/4885MMP8 3871/4885

“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.