SCHEMBL3200520

SCHEMBL3200520

CCCNCCCN1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.59
HPGD P15428 1/20 0.53
DUSP3 P51452 1/20 0.53
ALDH1A1 P00352 2/20 0.51
CYP2C19 P33261 2/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
KDM1A O60341 2/20 0.49
KEAP1 Q14145 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAPK1 P28482 3/20 0.47
GAA P10253 1/20 0.47
CYP1A2 P05177 1/20 0.47
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
HTR2A P28223 1/20 0.47
SCN1A P35498 1/20 0.47
HTR2B P41595 1/20 0.47
KCNH2 Q12809 1/20 0.47
SCN2A Q99250 1/20 0.47

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
SCHEMBL2238005 0.92 PAOX (0.59) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL540786 0.91 PAOX (0.62) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL721355 0.90 PAOX (0.64) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL20966331 0.89 PAOX (0.65) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL169004 0.89 PAOX (0.65) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL13520192 0.88 TSHR (0.49) PAOXHPGDDUSP3ALDH1A1CYP2D6
Hydrochloric Acid SCHEMBL2488967 0.88 PAOX (0.62) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL22317835 0.87 PAOX (0.58) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL76577 0.86 PAOX (0.57) PAOXHPGDDUSP3ALDH1A1CYP2C19
SCHEMBL13822725 0.86 ACE2 (0.48) PAOXALDH1A1SMN1; SMN2USP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119751380-A Polyamine heterocyclic compound, preparation method and application thereof, and polyamine heterocyclic compound combined solution 大连理工大学 2025-04-04 CN disclosed
EP-2121771-B2 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2016-12-07 EP disclosed
EP-3099691-A1 PRO-SUBSTRATES FOR LIVE CELL APPLICATIONS Promega Corporation (US) 2016-12-07 EP disclosed
WO-2015116806-A1 PRO-SUBSTRATES FOR LIVE CELL APPLICATIONS PROMEGA CORPORATION (US) 2015-08-06 WO disclosed
CN-103328597-A Two-component curable composition HENKEL AG & CO KGAA 2013-09-25 CN disclosed
CN-102037039-B Hardenable compositions based on silylated polyurethanes HENKEL AG & CO KGAA 2013-08-21 CN disclosed
US-8338499-B2 Amine co-initiators for radiation curable compositions AGFA GRAPHICS NV (BE) 2012-12-25 US disclosed
US-8338499-B2 Amine co-initiators for radiation curable compositions AGFA GRAPHICS NV (BE) 2012-12-25 US disclosed
US-8338499-B2 Amine co-initiators for radiation curable compositions AGFA GRAPHICS NV (BE) 2012-12-25 US disclosed
EP-2121771-B1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2012-06-27 EP disclosed
US-20100041784-A1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2010-02-18 US disclosed
US-20100041784-A1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2010-02-18 US disclosed
EP-1485377-B1 PYRANONES USEFUL AS ATM INHIBITORS KUDOS PHARM LTD (GB) 2009-12-09 EP disclosed
EP-2121771-A1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA Graphics NV (BE) 2009-11-25 EP disclosed
WO-2008074758-A1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2008-06-26 WO disclosed
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 US disclosed
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 US disclosed
EP-0201164-B1 POLYOLEFIN GRAFT POLYMERS AND LUBRICATING COMPOSITIONS CONTAINING THEM TEXACO DEVELOPMENT CORPORATION (US) 1992-09-30 EP disclosed
US-4640788-A LUBRICANTS TEXACO INC. (US) 1987-02-03 US disclosed
EP-0201164-A2 Polyolefin graft polymers and lubricating compositions containing them TEXACO DEVELOPMENT CORPORATION (US) 1986-11-12 EP 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-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine CXCR4, CXCR1, CXCR3 PAOX 1036/4885HPGD 708/4885DUSP3 889/4885

“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.