SCHEMBL12437751

SCHEMBL12437751

CCN1CCCC1CNC(=O)c1ccc(OC2CCN(Cc3ccc4c(c3)c3ccccc3n4CC)CC2)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.49
BACE1 P56817 2/20 0.48
LMNA P02545 4/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HPGD P15428 2/20 0.46
MAPT P10636 4/20 0.45
TP53 P04637 2/20 0.45
TSHR P16473 1/20 0.45
NPY1R P25929 1/20 0.45
DRD2 P14416 3/20 0.44
UTS2R Q9UKP6 1/20 0.44

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
SCHEMBL12513991 0.94 KCNH2 (0.51) KCNH2BACE1LMNAALDH1A1SMN1; SMN2
SCHEMBL12437741 0.88 UTS2R (0.47) LMNAALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL12437739 0.88 BCHE (0.53) LMNAALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL12513887 0.88 ALDH1A1 (0.48) KCNH2BACE1LMNAALDH1A1SMN1; SMN2
SCHEMBL12437738 0.87 UTS2R (0.52) MAPTTP53DRD2UTS2R
SCHEMBL12437702 0.84 MEN1 (0.47) MAPTTP53DRD2UTS2R
SCHEMBL12437723 0.84 MAPT (0.51) ALDH1A1KDM4EMAPTTP53UTS2R
SCHEMBL12437827 0.84 CACNA1G (0.49) ALDH1A1KDM4EMAPTUTS2R
SCHEMBL12437875 0.84 UTS2R (0.45) LMNAALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL12437857 0.84 TP53 (0.45) LMNAALDH1A1SMN1; SMN2KDM4EMAPT

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 KCNH2 4831/4885BACE1 3038/4885LMNA 2809/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD KCNH2 4831/4885BACE1 3038/4885LMNA 2809/4885

“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.