SCHEMBL486412

SCHEMBL486412

CCCC(N)N1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.44
SLC6A3 Q01959 15/20 0.38
SLC6A2 P23975 12/20 0.36
SLC6A4 P31645 8/20 0.35
HRH3 Q9Y5N1 1/20 0.34
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL3585121 0.98 DPP7 (0.41) DPP7SLC6A3SLC6A2SLC6A4
SCHEMBL5672147 0.87
SCHEMBL1615519 0.87 OPRM1 (0.31) DPP7SLC6A3
SCHEMBL7771636 0.86 HRH3 (0.42) DPP7SLC6A3HRH3MAPTMAPK1
SCHEMBL5839699 0.85 OPRM1 (0.43) DPP7HRH3MAPTMAPK1NPSR1
SCHEMBL8390873 0.85 OPRM1 (0.43) DPP7HRH3MAPTMAPK1NPSR1
SCHEMBL2914564 0.84 HRH3 (0.40) DPP7SLC6A3SLC6A2HRH3MAPT
SCHEMBL486442 0.80 DPP7 (0.47) DPP7
SCHEMBL28047132 0.78 DPP7 (0.45) DPP7
SCHEMBL8557598 0.77 KMT2A (0.37) SLC6A3SLC6A2SLC6A4MAPTNPSR1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113087654-B Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2022-12-23 CN claimed
CN-113087654-A Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2021-07-09 CN claimed
CN-113087654-B Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2022-12-23 CN disclosed
CN-113087654-B Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2022-12-23 CN disclosed
CN-113087654-B Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2022-12-23 CN disclosed
CN-113087654-A Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2021-07-09 CN disclosed
CN-113087654-A Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2021-07-09 CN disclosed
CN-113087654-A Preparation method of piperidine-4-butylamine 苏州昊帆生物股份有限公司 2021-07-09 CN disclosed
WO-2012038905-A1 THIENOPYRIDINE NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-03-29 WO disclosed
WO-2012038904-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-03-29 WO disclosed
US-20120053170-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF AS ANTICANCER DRUGS SANOFI (FR) 2012-03-01 US disclosed
US-20100016343-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS WYETH (US) 2010-01-21 US disclosed
US-20100016360-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS WYETH (US) 2010-01-21 US disclosed
CN-101495465-A 2-phenyl-5-amino-1,3,4-oxadiazoles and their use as nicotinic acetylcholine receptor ligands GLAXO GROUP LTD (GB) 2009-07-29 CN disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
EP-2021331-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-02-11 EP disclosed
WO-2007138033-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2007-12-06 WO disclosed
US-5153327-A 7-Oxabicycloheptyl substituted heterocyclic amide or ester prostaglandin analogs useful in the treatment of thrombotic and vasospastic disease E. R. SQUIBB & SONS, INC. (US) 1992-10-06 US disclosed
US-5100889-A Thromboxane A2 receptor antagonists, thromboxane synthetase inhibitor E. R. SQUIBB & SONS, INC. (US) 1992-03-31 US disclosed
US-4273850-A 2,5-DIALKOXY-4-ARYLMERCAPTOBENZENE DIAZONIUM SALTS AND A HYDROXYNAPHTHALENE DISULFONAMIDE COUPLER HOECHST AKTIENGESELLSCHAFT (DE) 1981-06-16 US 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 (4 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-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA5, CHRNA2 DPP7 862/4885SLC6A3 456/4885SLC6A2 341/4885
US-20120053170-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF AS ANTICANCER DRUGS NAMPT, NNT, NQO1 DPP7 1947/4885SLC6A3 1701/4885SLC6A2 605/4885
US-20100016343-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS CHRNA7, CHRNA6, CHRNA2 DPP7 479/4885SLC6A3 443/4885SLC6A2 372/4885
US-20100016360-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS CHRNA7, CHRNA6, CHRNA2 DPP7 479/4885SLC6A3 443/4885SLC6A2 372/4885

“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.