SCHEMBL12437762

SCHEMBL12437762

CN1CCCCC1CNC(=O)c1ccc(OC2CCN(CC(c3ccccc3)c3ccccc3)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
OPRM1 P35372 2/20 0.51
OPRD1 P41143 2/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.49
PKM P14618 1/20 0.48
SLC5A7 Q9GZV3 1/20 0.48
RAB9A P51151 3/20 0.47
USP5 P45974 1/20 0.47
NPC1 O15118 1/20 0.46
MCHR2 Q969V1 1/20 0.46
MCHR1 Q99705 1/20 0.46
POLB P06746 2/20 0.45
SRD5A1 P18405 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL12437663 0.88 OPRM1 (0.54) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437529 0.87 MCHR1 (0.60) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437746 0.87 OPRK1 (0.45) MEN1KMT2ASLC5A7
SCHEMBL12437340 0.85 HRH3 (0.68) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437525 0.84 HRH3 (0.69) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437532 0.84 HRH3 (0.69) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437601 0.83 MEN1 (0.53) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437341 0.83 OPRM1 (0.61) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437543 0.83 HRH3 (0.56) HRH3MEN1KMT2AOPRM1OPRD1
SCHEMBL12437582 0.83 HRH3 (0.59) HRH3MEN1KMT2AOPRM1OPRD1

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-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

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 HRH3 788/4885MEN1 3974/4885KMT2A 2446/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD HRH3 788/4885MEN1 3974/4885KMT2A 2446/4885

“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.