SCHEMBL3940164

SCHEMBL3940164

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

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
CYP2C9 P11712 1/20 0.36
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
REN P00797 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
RORC P51449 2/20 0.33
CASP3 P42574 2/20 0.33
CASP7 P55210 2/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL3929617 0.94 POLB (0.38) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL3941152 0.93 POLB (0.36) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL3930170 0.93 POLB (0.37) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL3933940 0.93 POLB (0.37) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL4051417 0.91 REN (0.36) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL3936233 0.91 POLB (0.35) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL3933697 0.90 POLB (0.36) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL4047973 0.90 POLB (0.37) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL3935953 0.90 CYP2C9 (0.38) POLBCYP2C9KMT2ALMNASMN1; SMN2
SCHEMBL3944010 0.89 CYP2C9 (0.37) POLBCYP2C9KMT2ALMNASMN1; 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 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 2600/4885CYP2C9 619/4885KMT2A 3832/4885

“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.