SCHEMBL2248193

SCHEMBL2248193

OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4CC5CCC4C5)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 12/20 1.00
ADORA3 P0DMS8 5/20 1.00
ADORA2A P29274 4/20 1.00
ADORA2B P29275 2/20 1.00
HIF1A Q16665 1/20 1.00
LMNA P02545 1/20 1.00
MAPT P10636 1/20 1.00
BLM P54132 1/20 1.00
PMP22 Q01453 1/20 1.00
HTR7 P34969 1/20 0.84
TMEM97 Q5BJF2 1/20 0.84
SIGMAR1 Q99720 1/20 0.84

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
SCHEMBL29359496 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL29599389 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL12265125 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL13276118 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL10529743 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL31060879 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL10608249 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL14829269 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL21033426 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A
SCHEMBL10529777 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110207689-A1 THE TREATMENT OF HEARING LOSS AUCKLAND UNISERVICES LIMITED 2011-08-25 US claimed
US-20140336142-A1 Method For Treatment Of Macular Degeneration By Modulating P2Y12 or P2X7 Receptors MITCHELL CLAIRE (US) 2014-11-13 US disclosed
EP-2701719-A1 METHOD FOR TREATMENT OF MACULAR DEGENERATION BY MODULATING P2Y12 OR P2X7 RECEPTORS Mitchell, Claire (US) 2014-03-05 EP disclosed
US-20130338145-A1 Method for Mediating Dopamine Receptor-Driven Reacidification of Lysosomal pH MITCHELL CLAIRE H (US) 2013-12-19 US disclosed
WO-2012149285-A1 METHOD FOR TREATMENT OF MACULAR DEGENERATION BY MODULATING P2Y12 OR P2X7 RECEPTORS MITCHELL CLAIRE (US) 2012-11-01 WO disclosed
US-20110207689-A1 THE TREATMENT OF HEARING LOSS AUCKLAND UNISERVICES LIMITED 2011-08-25 US disclosed
US-20110207689-A1 THE TREATMENT OF HEARING LOSS AUCKLAND UNISERVICES LIMITED 2011-08-25 US disclosed
US-20090247483-A1 Method for Treatment of Macular Degeneration NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-10-01 US disclosed
EP-2089016-A2 METHOD FOR TREATMENT OF MACULAR DEGENERATION The Trustees of the University of Pennsylvania (US) 2009-08-19 EP disclosed
WO-2008042399-A9 METHOD FOR TREATMENT OF MACULAR DEGENERATION UNIV PENNSYLVANIA (US) 2008-07-03 WO disclosed
WO-2008042399-A2 METHOD FOR TREATMENT OF MACULAR DEGENERATION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2008-04-10 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-20110207689-A1 THE TREATMENT OF HEARING LOSS ADORA1, ADORA2A, ADORA3 ADORA1 1/4885ADORA3 3/4885ADORA2A 2/4885

“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.