SCHEMBL12437352

SCHEMBL12437352

CCC(CN1CCC(Oc2ccc(C(=O)NCCCN3CCCC3)cc2Cl)CC1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC5A7 Q9GZV3 2/20 0.49
SMYD2 Q9NRG4 3/20 0.46
OPRK1 P41145 1/20 0.44
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44
F10 P00742 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SLC6A2 P23975 3/20 0.43
SLC6A4 P31645 3/20 0.43
HRH3 Q9Y5N1 1/20 0.43
OPRM1 P35372 2/20 0.43
OPRD1 P41143 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CCR3 P51677 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL12437349 0.91 SLC5A7 (0.53) SLC5A7SMYD2OPRK1DRD2DRD4
SCHEMBL12437957 0.91 SLC5A7 (0.51) SLC5A7SMYD2OPRK1DRD2DRD4
SCHEMBL12437336 0.89 SLC5A7 (0.50) SLC5A7SMYD2OPRK1DRD2DRD4
SCHEMBL12437776 0.87 SMYD2 (0.49) SLC5A7SMYD2DRD2DRD4DRD3
SCHEMBL12437354 0.86 DRD2 (0.56) SLC5A7SMYD2DRD2DRD3HRH3
SCHEMBL12437948 0.86 SLC5A7 (0.56) SLC5A7OPRK1MEN1KMT2AHRH3
SCHEMBL12437947 0.85 SLC5A7 (0.56) SLC5A7OPRK1F10MEN1KMT2A
SCHEMBL12437332 0.85 UTS2R (0.55) SLC5A7SMYD2MEN1KMT2ASLC6A2
SCHEMBL12437345 0.85 SMYD2 (0.51) SLC5A7SMYD2DRD2DRD3MEN1
SCHEMBL12437337 0.84 ALDH1A1 (0.58) SLC5A7SMYD2MEN1KMT2ASLC6A2

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 2 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

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-20110178066-A1 Hydroxypiperidine derivatives and uses thereof HPGDS, HPGD, DPYD SLC5A7 4329/4885SMYD2 2555/4885OPRK1 980/4885

“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.