SCHEMBL218999

SCHEMBL218999

O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNPH1 O43598 4/20 1.00
P2RX3 P56373 2/20 0.86
P2RX2 Q9UBL9 2/20 0.86
NT5E P21589 5/20 0.84
ADORA3 P0DMS8 7/20 0.74
TP53 P04637 1/20 0.74
SLC29A1 Q99808 1/20 0.74
TDP1 Q9NUW8 1/20 0.74
P2RY12 Q9H244 1/20 0.73
TAS1R3 Q7RTX0 1/20 0.67
TAS1R1 Q7RTX1 1/20 0.67
P2RX4 Q99571 1/20 0.67

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
SCHEMBL13972003 1.00 DNPH1 (1.00) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL14700471 1.00 DNPH1 (1.00) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL13957724 1.00 DNPH1 (1.00) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL17022278 1.00 DNPH1 (1.00) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL29564113 1.00 DNPH1 (1.00) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL23440101 1.00 DNPH1 (1.00) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL9607782 0.93 P2RX3 (0.98) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL30076630 0.93 P2RX3 (0.98) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL29941330 0.93 P2RX3 (0.98) DNPH1P2RX3P2RX2NT5EADORA3
SCHEMBL13033867 0.93 P2RX3 (0.98) DNPH1P2RX3P2RX2NT5EADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN AKRON MOLECULES AG (AT) 2014-11-27 US claimed
US-20130252924-A1 Compounds and Methods for Treating Pain AKRON MOLECULES GMBH (AT) 2013-09-26 US claimed
US-20090203638-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION VDF FUTURECEUTICALS, INC. (US) 2009-08-13 US claimed
US-20070161582-A1 Pharmaceutical compositions and methods for metabolic modulation VDF FUTURECEUTICALS 2007-07-12 US claimed
WO-2005020892-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION MITOCHROMA RESEARCH, INC. (US) 2005-03-10 WO claimed
EP-0355825-A2 Viral treatment system Prendergast, Patrick T. (IE) 1990-02-28 EP claimed
US-12201075-B2 Methods and compositions for axillary shoot micropropagation of Cannabis and related plants JUSHI IP, LLC (US) 2025-01-21 US disclosed
US-20230265444-A1 GENE-EDITING IN CANNABIS PLANT CANOPY GROWTH CORPORATION (CA) 2023-08-24 US disclosed
EP-4228397-A1 METHODS AND COMPOSITIONS FOR AXILLARY SHOOT MICROPROPAGATION OF CANNABIS AND RELATED PLANTS Phytotech Labs, Inc. (US) 2023-08-23 EP disclosed
EP-3436601-B1 CYTIDINE DEAMINASE EXPRESSION LEVEL IN CANCER AS A NEW THERAPEUTIC TARGET CENTRE NAT RECH SCIENT (FR) 2023-03-29 EP disclosed
WO-2022081767-A1 METHODS AND COMPOSITIONS FOR AXILLARY SHOOT MICROPROPAGATION OF CANNABIS AND RELATED PLANTS PHYTOTECH LABS, INC. (US) 2022-04-21 WO disclosed
US-20220110278-A1 METHODS AND COMPOSITIONS FOR AXILLARY SHOOT MICROPROPAGATION OF CANNABIS AND RELATED PLANTS JUSHI IP, LLC 2022-04-14 US disclosed
US-11209421-B2 Cytidine deaminase expression level in cancer as a new therapeutic target CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-12-28 US disclosed
EP-2026810-A2 COMPOSITIONS AND METHODS FOR MODULATING THE IMMUNE SYSTEM Prendergast, Patrick T. (AU) 2009-02-25 EP disclosed
WO-2007131973-A2 COMPOSITIONS AND METHODS FOR MODULATING THE IMMUNE SYSTEM PRENDERGAST PATRICK T (AU) 2007-11-22 WO disclosed
US-20070184067-A1 Alimentary compositions and methods for metabolic modulation VDF FUTURECEUTICALS 2007-08-09 US disclosed
US-20070161582-A1 Pharmaceutical compositions and methods for metabolic modulation VDF FUTURECEUTICALS 2007-07-12 US disclosed
WO-2005020892-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION MITOCHROMA RESEARCH, INC. (US) 2005-03-10 WO disclosed
WO-2005016268-A2 ALIMENTARY COMPOSITIONS AND METHODS FOR METABOLIC MODULATION MITOCHROMA RESEARCH, INC. (US) 2005-02-24 WO disclosed
EP-0355825-A2 Viral treatment system Prendergast, Patrick T. (IE) 1990-02-28 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 (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-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN TRPV1, ACHE, OPRL1 DNPH1 1734/4885P2RX3 5/4885P2RX2 17/4885
US-20130252924-A1 Compounds and Methods for Treating Pain TRPV1, ACHE, OPRL1 DNPH1 1734/4885P2RX3 5/4885P2RX2 17/4885
US-20070161582-A1 Pharmaceutical compositions and methods for metabolic modulation GPR119, PRKAG2, PRKAG1 DNPH1 3996/4885P2RX3 287/4885P2RX2 193/4885
US-20090203638-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION GPR119, PRKAG2, GCKR DNPH1 3917/4885P2RX3 247/4885P2RX2 162/4885

“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.