SCHEMBL6791438

SCHEMBL6791438

CN(C)C(=O)C1CCCN(Cc2ccccc2)C1

nearest known ligand 0.77

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.77
HTT P42858 3/20 0.69
PKM P14618 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
ALDH1A1 P00352 4/20 0.63
HPGD P15428 1/20 0.63
CYP2D6 P10635 1/20 0.62
CYP3A4 P08684 2/20 0.60
CYP2C9 P11712 2/20 0.60
CYP1A2 P05177 1/20 0.60
LMNA P02545 1/20 0.59
BCHE P06276 2/20 0.58
POLB P06746 1/20 0.58
ATM Q13315 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
TDP1 Q9NUW8 1/20 0.56
ACHE P22303 1/20 0.55

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
SCHEMBL6791434 1.00 KDM4E (0.77) KDM4EHTTPKMSMN1; SMN2MEN1
SCHEMBL12009956 0.92 KDM4E (0.64) KDM4EHTTPKMSMN1; SMN2MEN1
SCHEMBL5551098 0.90 KDM4E (0.73) KDM4EHTTPKMSMN1; SMN2MEN1
SCHEMBL14697252 0.87 KDM4E (0.70) KDM4EHTTPKMSMN1; SMN2MEN1
SCHEMBL9458519 0.87 HTT (0.89) KDM4EHTTPKMSMN1; SMN2MEN1
Bromide SCHEMBL9458818 0.86 HTT (0.87) KDM4EHTTPKMSMN1; SMN2MEN1
Bromide SCHEMBL9458813 0.86 HTT (0.87) KDM4EHTTPKMSMN1; SMN2MEN1
SCHEMBL23182183 0.85 KDM4E (0.70) KDM4EHTTPKMSMN1; SMN2MEN1
SCHEMBL4512048 0.85 KDM4E (0.70) KDM4EHTTPKMSMN1; SMN2MEN1
SCHEMBL18125935 0.84 ALDH1A1 (0.71) KDM4EHTTPKMSMN1; SMN2MEN1

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-20040039206-A1 Process for resolving racemic mixtures of piperidine derivatives MOHER ERIC DAVID (US) 2004-02-26 US disclosed
US-6664271-B1 Amide, carbamate and uredo derivatives of 3-piperidine-carboxylic acid or ester; protecting against infection by such as escherichia coli and/or actinobacillus pleuropneumoniae ELI LILLY AND COMPANY 2003-12-16 US disclosed
EP-1341762-A1 PROCESS FOR RESOLVING RACEMIC MIXTURES OF PIPERIDINE DERIVATIVES ELI LILLY AND COMPANY (US) 2003-09-10 EP disclosed
WO-2002068391-A1 PROCESS FOR RESOLVING RACEMIC MIXTURES OF PIPERIDINE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-09-06 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-20040039206-A1 Process for resolving racemic mixtures of piperidine derivatives SRR, OPRM1, SRM KDM4E 4060/4885HTT 3257/4885PKM 3192/4885

“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.