SCHEMBL3942287

SCHEMBL3942287

O[C@H]1C[C@@H](C(O)(c2ccccc2)c2ccccc2)N(Cc2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
KCNH2 Q12809 1/20 0.41
FUCA1 P04066 2/20 0.41
HRH1 P35367 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
GBA1 P04062 1/20 0.38
SIGMAR1 Q99720 2/20 0.37

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
SCHEMBL30577761 1.00 MAPT (0.46) MAPTKCNH2FUCA1HRH1ALDH1A1
SCHEMBL26670253 1.00 MAPT (0.46) MAPTKCNH2FUCA1HRH1ALDH1A1
SCHEMBL27469314 0.84 MAPT (0.50) MAPTFUCA1ALDH1A1KDM4EL3MBTL1
SCHEMBL5378993 0.84 MAPT (0.50) MAPTFUCA1ALDH1A1KDM4EL3MBTL1
SCHEMBL15483528 0.83 LMNA (0.34) MAPTKCNH2HRH1ALDH1A1KDM4E
SCHEMBL15451296 0.83 LMNA (0.34) MAPTKCNH2HRH1ALDH1A1KDM4E
SCHEMBL15451298 0.83 LMNA (0.34) MAPTKCNH2HRH1ALDH1A1KDM4E
SCHEMBL15456861 0.83 LMNA (0.34) MAPTKCNH2HRH1ALDH1A1KDM4E
SCHEMBL13788753 0.78 LMNA (0.41) KCNH2HRH1ALDH1A1KDM4EL3MBTL1
SCHEMBL8661016 0.77 MAPT (0.41) MAPTFUCA1ALDH1A1KDM4EL3MBTL1

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 MAPT 4007/4885KCNH2 104/4885FUCA1 2351/4885

“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.