SCHEMBL12437728

SCHEMBL12437728

CCN(CCCNC(=O)c1ccc(OC2CCN(CC(c3ccccc3)c3ccccc3)CC2)c(Cl)c1)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.48
USP7 Q93009 2/20 0.48
TMEM97 Q5BJF2 2/20 0.47
SIGMAR1 Q99720 2/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
OPRM1 P35372 2/20 0.44
OPRD1 P41143 2/20 0.44
ALDH1A1 P00352 1/20 0.44
UTS2R Q9UKP6 2/20 0.44
SLC5A7 Q9GZV3 1/20 0.43
SLC2A1 P11166 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ACKR3 P25106 1/20 0.41

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
SCHEMBL12437952 0.89 MEN1 (0.46) TMEM97SIGMAR1MEN1KMT2AOPRM1
SCHEMBL12437721 0.87 MEN1 (0.45) MEN1KMT2AOPRM1OPRD1ALDH1A1
SCHEMBL12437767 0.87 USP7 (0.44) APPUSP7TMEM97SIGMAR1MEN1
SCHEMBL12437595 0.87 OPRM1 (0.58) APPUSP7SIGMAR1MEN1KMT2A
SCHEMBL12437612 0.87 MEN1 (0.63) APPTMEM97SIGMAR1MEN1KMT2A
SCHEMBL12437718 0.86 MEN1 (0.46) MEN1KMT2AUTS2RSLC5A7
SCHEMBL12437944 0.85 KMT2A (0.47) MEN1KMT2AUTS2RSLC5A7SMN1; SMN2
SCHEMBL12437719 0.84 MEN1 (0.48) MEN1KMT2AUTS2RSLC5A7
SCHEMBL12437755 0.83 UTS2R (0.47) APPUSP7TMEM97SIGMAR1UTS2R
SCHEMBL12437957 0.83 SLC5A7 (0.51) MEN1KMT2AOPRM1OPRD1ALDH1A1

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 APP 3607/4885USP7 1358/4885TMEM97 1986/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD APP 3607/4885USP7 1358/4885TMEM97 1986/4885

“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.