SCHEMBL3941150

SCHEMBL3941150

COc1ccc(CO[C@@H]2CC[C@@H](CC(OC)C(=O)N3C(=O)OCC3Cc3ccccc3)N(S(=O)(=O)c3ccc(C)cc3)C2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.37
MMP3 P08254 9/20 0.37
MMP9 P14780 9/20 0.37
MMP7 P09237 6/20 0.37
MMP13 P45452 4/20 0.37
MAPT P10636 2/20 0.37
MMP2 P08253 9/20 0.37
LMNA P02545 2/20 0.37
MMP8 P22894 4/20 0.36
FKBP1A P62942 1/20 0.36
MMP12 P39900 2/20 0.36
MMP14 P50281 2/20 0.36
MMP15 P51511 2/20 0.36
MMP16 P51512 2/20 0.36
MMP26 Q9NRE1 2/20 0.36
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL3941142 1.00 MMP1 (0.37) MMP1MMP3MMP9MMP7MMP13
SCHEMBL3942427 0.92 MMP1 (0.37) MMP1MMP3MMP9MMP7MMP13
SCHEMBL3942432 0.92 MMP1 (0.37) MMP1MMP3MMP9MMP7MMP13
SCHEMBL3933301 0.87 MMP1 (0.38) MMP1MMP3MMP9MMP7MMP13
SCHEMBL3933307 0.87 MMP1 (0.38) MMP1MMP3MMP9MMP7MMP13
SCHEMBL3942310 0.86 FKBP1A (0.38) MMP1MAPTMMP2FKBP1AALDH1A1
SCHEMBL3942316 0.86 FKBP1A (0.38) MMP1MAPTMMP2FKBP1AALDH1A1
SCHEMBL3933140 0.75 FKBP1A (0.46) MMP1MAPTLMNAFKBP1AUSP2
SCHEMBL4162834 0.75 FKBP1A (0.46) MMP1MAPTLMNAFKBP1AUSP2
SCHEMBL3940677 0.75 FKBP1A (0.45) MMP1MMP3MMP9MMP7MMP13

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
US-20090306062-A1 2,5-Disubstituted Piperidines NOVARTIS AG (CH) 2009-12-10 US disclosed
WO-2009106599-A2 SUBSTITUTED PIPERIDINES AS THERAPEUTIC COMPOUNDS NOVARTIS AG (CH) 2009-09-03 WO disclosed
EP-2044059-A1 2,5-DISUBSTITUTED PIPERIDINES Speedel Experimenta AG (CH) 2009-04-08 EP disclosed
WO-2007141318-A1 2,5-DISUBSTITUTED PIPERIDINES SPEEDEL EXPERIMENTA AG (CH) 2007-12-13 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-20090306062-A1 2,5-Disubstituted Piperidines REN, AGTR1, AGTR2 MMP1 918/4885MMP3 1353/4885MMP9 1873/4885

“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.