SCHEMBL12437962

SCHEMBL12437962

CN(C)CCCN(C)C(=O)c1ccc(OC2CCN(CC(c3ccccc3)c3ccccc3)CC2)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
EPHX2 P34913 1/20 0.42
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HRH1 P35367 2/20 0.40
CCR3 P51677 2/20 0.40
KCNH2 Q12809 1/20 0.40
ACHE P22303 1/20 0.39
SCN8A Q9UQD0 2/20 0.38
TACR2 P21452 2/20 0.38
UTS2R Q9UKP6 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
SCHEMBL12437961 0.95 OPRK1 (0.46) OPRK1L3MBTL1EPHX2POLBMAPT
SCHEMBL12437780 0.89 OPRK1 (0.44) OPRK1L3MBTL1EPHX2POLBMAPT
SCHEMBL12437952 0.86 MEN1 (0.46) OPRK1EPHX2UTS2R
SCHEMBL12437944 0.84 KMT2A (0.47) OPRK1EPHX2HRH1CCR3KCNH2
SCHEMBL2214246 0.83 EPHX2 (0.55) EPHX2HRH1CCR3KCNH2UTS2R
SCHEMBL12437734 0.78 HRH1 (0.46) OPRK1EPHX2HRH1CCR3KCNH2
SCHEMBL12437721 0.78 MEN1 (0.45) OPRK1EPHX2HRH1CCR3KCNH2
SCHEMBL12437960 0.78 OPRK1 (0.44) OPRK1L3MBTL1EPHX2POLBMAPT
SCHEMBL12437883 0.78 OPRK1 (0.45) OPRK1EPHX2HRH1CCR3KCNH2
SCHEMBL12437719 0.78 MEN1 (0.48) OPRK1EPHX2HRH1CCR3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110178066-A1 Hydroxypiperidine derivatives and uses thereof AVALON PHARMACEUTICALS 2011-07-21 US disclosed
US-20110178066-A1 Hydroxypiperidine derivatives and uses thereof AVALON PHARMACEUTICALS 2011-07-21 US disclosed
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof AVALON PHARMACEUTICALS 2009-02-05 US disclosed
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof AVALON PHARMACEUTICALS 2009-02-05 US disclosed
WO-2007098086-A2 HYDROXYPIPERIDINE DERIVATIVES AND USES THEREOF AVALON PHARMACEUTICALS (US) 2007-08-30 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 (2 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-20110178066-A1 Hydroxypiperidine derivatives and uses thereof HPGDS, HPGD, DPYD OPRK1 980/4885L3MBTL1 4206/4885EPHX2 1406/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD OPRK1 980/4885L3MBTL1 4206/4885EPHX2 1406/4885

“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.