SCHEMBL12437475

SCHEMBL12437475

CCN(CC)C(CNC(=O)c1cccc(OC2CCCN(CC(c3ccccc3)c3ccccc3)C2)c1)c1ccco1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
SLC5A7 Q9GZV3 2/20 0.42
PRMT5 O14744 2/20 0.42
WDR77 Q9BQA1 2/20 0.42
ALDH1A1 P00352 3/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.38
MAPK1 P28482 1/20 0.38
KAT6A Q92794 1/20 0.37

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
SCHEMBL12437587 0.91 KMT2A (0.53) POLBKMT2AMEN1SLC5A7PRMT5
SCHEMBL12437477 0.86 HTT (0.51) KMT2AMEN1ALDH1A1HTT
SCHEMBL12437496 0.84 ATM (0.49) KMT2AMEN1PRMT5WDR77ALDH1A1
SCHEMBL12437585 0.82 ALDH1A1 (0.47) KMT2AMEN1SLC5A7ALDH1A1OPRM1
SCHEMBL12437394 0.81 MEN1 (0.51) POLBKMT2AMEN1SLC5A7ALDH1A1
SCHEMBL12437564 0.81 MEN1 (0.44) POLBKMT2AMEN1SLC5A7PRMT5
SCHEMBL12437557 0.81 MEN1 (0.44) KMT2AMEN1SLC5A7PRMT5WDR77
SCHEMBL12437471 0.81 KMT2A (0.44) KMT2AMEN1SLC5A7PRMT5WDR77
SCHEMBL12437562 0.81 KMT2A (0.44) POLBKMT2AMEN1SLC5A7PRMT5
SCHEMBL12437369 0.81 MEN1 (0.51) POLBKMT2AMEN1SLC5A7RAB9A

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 POLB 675/4885KMT2A 2446/4885MEN1 3974/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD POLB 675/4885KMT2A 2446/4885MEN1 3974/4885

“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.