Azepane

Azepane

SCHEMBL1450973

C1CCCNCC1.O=[PH](O)O.O=[PH](O)O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.60
CXCR4 P61073 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA2 P00918 1/20 0.35
CHKA P35790 1/20 0.35
HIF1A Q16665 1/20 0.31
MAPT P10636 1/20 0.31
PDE4A P27815 1/20 0.31
KDR P35968 1/20 0.31
EPHX1 P07099 1/20 0.31

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
Piperidine SCHEMBL9520159 1.00 ALDH1A1 (0.60) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Piperidine SCHEMBL15517892 0.97 ALDH1A1 (0.56) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Piperidine SCHEMBL15511100 0.97 ALDH1A1 (0.56) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Piperidine SCHEMBL15511101 0.97 ALDH1A1 (0.56) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Azepane SCHEMBL5164365 0.97 ALDH1A1 (0.56) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Piperidine SCHEMBL15517893 0.97 ALDH1A1 (0.56) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Pyrrolidine SCHEMBL11618713 0.97 ALDH1A1 (0.53) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Piperidine SCHEMBL15570570 0.94 ALDH1A1 (0.53) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Piperidine SCHEMBL15572305 0.94 ALDH1A1 (0.53) ALDH1A1CXCR4SMN1; SMN2CA2CHKA
Piperidine SCHEMBL28020374 0.94 ALDH1A1 (0.53) ALDH1A1CXCR4SMN1; SMN2CA2CHKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2934694-B1 ANTI-PLAQUE ORAL COMPOSITIONS BHUSHAN RAJIV (US) 2023-06-28 EP claimed
EP-3105310-B1 NOVEL PERACID-CONTAINING PARTICLE SOC CHIMICA BUSSI S P A (IT) 2020-05-27 EP claimed
EP-1633471-B2 PERCARBOXYLIC ACID-BASED POLYELECTROLYTE CAPSULE SYSTEM HAVING A LONG SHELF LIFE HENKEL AG & CO KGAA (DE) 2017-10-18 EP claimed
EP-3105310-A2 NOVEL PERACID-CONTAINING PARTICLE Revolymer (U.K.) Limited (GB) 2016-12-21 EP claimed
US-20160348037-A1 NOVEL PERACID-CONTAINING PARTICLE REVOLYMER (U.K.) LIMITED (GB) 2016-12-01 US claimed
EP-1633468-B2 LIQUID WASHING OR CLEANING AGENT COMPOSITIONS COMPRISING PERCARBOXYLIC ACID-BASED CAPSULES HAVING A LONG SHELF LIFE HENKEL AG & CO KGAA (DE) 2016-10-19 EP claimed
EP-1948773-B1 FRAGRANT CONSUMER PRODUCTS COMPRISING OXIDIZING AGENTS HENKEL AG & CO KGAA (DE) 2016-03-30 EP claimed
US-20150335557-A1 ANTI-PLAQUE ORAL COMPOSITIONS BHUSNAN RAJIV (US) 2015-11-26 US claimed
EP-2934694-A1 ANTI-PLAQUE ORAL COMPOSITIONS Bhushan, Rajiv (US) 2015-10-28 EP claimed
WO-2015118357-A2 NOVEL PERACID-CONTAINING PARTICLE REVOLYMER (U.K) LIMITED (GB) 2015-08-13 WO claimed
EP-1633470-B1 PERCARBOXYLIC ACID-BASED BLEACH COMPOSITIONS HAVING A LONG SHELF LIFE HENKEL AG & CO KGAA (DE) 2010-07-21 EP claimed
EP-1633469-B1 METHOD FOR STABILISING PEROXYCARBOXYLIC ACIDS IN DISPERSIONS CONTAINING SURFACTANTS HENKEL AG & CO KGAA (DE) 2009-11-25 EP claimed
EP-1633471-B1 PERCARBOXYLIC ACID-BASED POLYELECTROLYTE CAPSULE SYSTEM HAVING A LONG SHELF LIFE HENKEL AG & CO KGAA (DE) 2009-03-25 EP claimed
EP-1633468-B1 PERCARBOXYLIC ACID-BASED CAPSULES HAVING A LONG SHELF LIFE HENKEL AG & CO KGAA (DE) 2009-01-14 EP claimed
US-20070032396-A1 Peroxycarboxylic acid-based capsules having a long shelf life HENKEL AG & CO. KGAA (DE) 2007-02-08 US claimed
US-20060178284-A1 Method for stabilizing percarboxylic acids in dispersions containing surfactants HENKEL AG & CO. KGAA (DE) 2006-08-10 US claimed
US-20060178285-A1 Peroxycaboxylic acid-based bleach compositions having a long shelf life HENKEL AG & CO. KGAA (DE) 2006-08-10 US claimed
US-20060172909-A1 Peroxycarboxylic acid-based polyelectrolyte capsule system having a long shelf life HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-08-03 US claimed
US-5158763-A Azacycloalkane diphosphonic acid or salt COLGATE-PALMOLIVE COMPANY (US) 1992-10-27 US claimed
EP-0480811-A2 Non-staining anti-bacterial oral composition Colgate-Palmolive Company (a Delaware corporation) (US) 1992-04-15 EP claimed

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-20150335557-A1 ANTI-PLAQUE ORAL COMPOSITIONS MGMT, CAPG, TRPM7 ALDH1A1 4865/4885CXCR4 3263/4885SMN1; SMN2 2331/4885
US-20160348037-A1 NOVEL PERACID-CONTAINING PARTICLE POLR1C, SDC1, PBDC1 ALDH1A1 2263/4885CXCR4 4688/4885SMN1; SMN2 3748/4885

“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.