SCHEMBL3930892

SCHEMBL3930892

COCCCN1CCOc2ccc(C(O[C@@H]3CC[C@@H](CBr)NC3)S(=O)(=O)c3ccc(C)cc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.36
KMT2A Q03164 2/20 0.33
CYP2C9 P11712 1/20 0.33
PKM P14618 1/20 0.32
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
NPY5R Q15761 2/20 0.30
RORC P51449 1/20 0.30

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
SCHEMBL3936238 0.89 REN (0.33) RENKMT2ACYP2C9POLB
SCHEMBL3928303 0.89 REN (0.35) RENKMT2ACYP2C9RORC
SCHEMBL3940558 0.88
SCHEMBL3938167 0.87 REN (0.32) RENKMT2A
SCHEMBL2922336 0.83 KMT2A (0.33) RENKMT2ACYP2C9PKMMAPT
SCHEMBL4961314 0.83 REN (0.32) RENKMT2APKM
SCHEMBL2918021 0.81 REN (0.31) RENKMT2A
SCHEMBL1518000 0.79
SCHEMBL1518001 0.79
SCHEMBL2388191 0.79 REN (0.30) REN

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 REN 1/4885KMT2A 3832/4885CYP2C9 619/4885

“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.