SCHEMBL12437799

SCHEMBL12437799

CCN(CC)CCNC(=O)c1ccc(OC2CCN(Cc3ccc(-c4ccccc4)cc3)CC2)c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.54
AKT2 P31751 2/20 0.54
AKT3 Q9Y243 2/20 0.54
UTS2R Q9UKP6 4/20 0.52
CHRM4 P08173 4/20 0.51
CCR3 P51677 1/20 0.47
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GLS O94925 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
SCHEMBL3110870 0.87 MCHR1 (0.45) AKT1AKT2AKT3CHRM4LMNA
SCHEMBL12437795 0.86 UTS2R (0.47) AKT1AKT2AKT3UTS2RCCR3
SCHEMBL12513958 0.84 SLC6A2 (0.54) UTS2RCCR3
SCHEMBL3109712 0.83 MCHR1 (0.45) AKT1AKT2AKT3MEN1KMT2A
SCHEMBL12437913 0.81 UTS2R (0.48) UTS2RCHRM4LMNAMEN1KMT2A
SCHEMBL12437829 0.81 CACNA1G (0.54) UTS2R
SCHEMBL12437718 0.80 MEN1 (0.46) UTS2RCCR3MEN1KMT2A
SCHEMBL17946117 0.80 UTS2R (0.55) UTS2RCCR3MEN1KMT2A
SCHEMBL12437721 0.79 MEN1 (0.45) UTS2RCCR3MEN1KMT2A
SCHEMBL12437722 0.79 UTS2R (0.45) UTS2RCCR3LMNASMN1; SMN2

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 AKT1 3346/4885AKT2 2541/4885AKT3 2316/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD AKT1 3346/4885AKT2 2541/4885AKT3 2316/4885

“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.