SCHEMBL5241137

SCHEMBL5241137

C1CCN(C2CCCCN2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.39
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CYP2D6 P10635 5/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
CHRM5 P08912 2/20 0.32
ADRA2C P18825 2/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MLNR O43193 1/20 0.32
ABCB11 O95342 1/20 0.32
EGFR P00533 1/20 0.32
FYN P06241 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 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
SCHEMBL6817248 1.00 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL616084 1.00 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL4023649 1.00 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL1181468 0.98 HTR6 (0.40) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL22628194 0.98 HTR6 (0.40) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL548524 0.95 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL9632289 0.93 KDM4E (0.38) HTR6MEN1KMT2AALDH1A1KDM4E
SCHEMBL28210606 0.93 MEN1 (0.36) HTR6MEN1KMT2AALDH1A1KDM4E
SCHEMBL1202752 0.93 MEN1 (0.36) HTR6MEN1KMT2AALDH1A1KDM4E
SCHEMBL9388849 0.93 HTR6 (0.40) HTR6MEN1KMT2ACYP2D6ALDH1A1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024216732-A1 METHOD FOR PREPARING PYRIDINE COMPOUND WITH META POSITION THEREOF SUBSTITUTED BY CHIRAL ALLYL 南开大学 2024-10-24 WO disclosed
CN-111269338-B Chelate resin with 4-piperidyl piperidine as ligand and preparation method and application thereof 台州学院 2021-04-13 CN disclosed
EP-3087077-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2018-10-31 EP disclosed
US-9839629-B2 Inhibitors of the renal outer medullary potassium channel MERCK SHARP & DOHME CORP. (US) 2017-12-12 US disclosed
US-20160324833-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME LLC 2016-11-10 US disclosed
EP-3087077-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL Merck Sharp & Dohme Corp. (US) 2016-11-02 EP disclosed
WO-2015100147-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2015-07-02 WO disclosed
WO-2015096035-A1 INHIBITORS OF RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2015-07-02 WO disclosed
EP-1740570-A2 NOVEL GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2007-01-10 EP disclosed
WO-2006102308-A2 BETA-LACTAMYL VASOPRESSIN V1B ANTAGONISTS AZEVAN PHARMACEUTICALS, INC. (US) 2006-09-28 WO disclosed
US-20060004004-A1 Novel gamma secretase inhibitors SCHERING CORPORATION 2006-01-05 US disclosed
WO-2005097768-A2 NOVEL GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2005-10-20 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-20060004004-A1 Novel gamma secretase inhibitors BACE1, BACE2, APP HTR6 4086/4885MEN1 4191/4885KMT2A 2876/4885
US-20160324833-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL KCNJ11, WNK1, KCNJ1 HTR6 2796/4885MEN1 383/4885KMT2A 2242/4885

“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.