SCHEMBL3936233

SCHEMBL3936233

COCCCN1CCOc2ccc(CO[C@@H]3CC[C@@H](CC(C)(C)OCCOC)N(S(=O)(=O)c4ccc(C)cc4)C3)cc21

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
CASP3 P42574 6/20 0.34
CASP7 P55210 6/20 0.34
CYP2C9 P11712 1/20 0.34
REN P00797 1/20 0.34
KMT2A Q03164 3/20 0.32
PKM P14618 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CASP1 P29466 1/20 0.32
CASP6 P55212 1/20 0.32
MAPT P10636 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL4051417 0.92 REN (0.36) POLBCASP3CASP7CYP2C9REN
SCHEMBL3933940 0.92 POLB (0.37) POLBCASP3CASP7CYP2C9REN
SCHEMBL3930170 0.92 POLB (0.37) POLBCASP3CASP7CYP2C9REN
SCHEMBL3940164 0.91 POLB (0.37) POLBCASP3CASP7CYP2C9REN
SCHEMBL3929617 0.90 POLB (0.38) POLBCYP2C9RENKMT2APKM
SCHEMBL4047973 0.90 POLB (0.37) POLBCYP2C9RENKMT2APKM
SCHEMBL3930886 0.89 CYP2C9 (0.36) POLBCASP3CASP7CYP2C9REN
SCHEMBL3935953 0.89 CYP2C9 (0.38) POLBCASP3CASP7CYP2C9REN
SCHEMBL3938162 0.89 POLB (0.34) POLBCASP3CASP7CYP2C9REN
SCHEMBL3941152 0.89 POLB (0.36) POLBCYP2C9RENKMT2APKM

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-20090306062-A1 2,5-Disubstituted Piperidines NOVARTIS AG (CH) 2009-12-10 US disclosed
WO-2009106599-A2 SUBSTITUTED PIPERIDINES AS THERAPEUTIC COMPOUNDS NOVARTIS AG (CH) 2009-09-03 WO disclosed
EP-2044059-A1 2,5-DISUBSTITUTED PIPERIDINES Speedel Experimenta AG (CH) 2009-04-08 EP disclosed
WO-2007141318-A1 2,5-DISUBSTITUTED PIPERIDINES SPEEDEL EXPERIMENTA AG (CH) 2007-12-13 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 (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-20090306062-A1 2,5-Disubstituted Piperidines REN, AGTR1, AGTR2 POLB 2600/4885CASP3 4629/4885CASP7 4322/4885

“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.