SCHEMBL249649

SCHEMBL249649

CCCCCNc1nc2nc[nH]c2c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
XDH P47989 6/20 1.00
POLA1 P09884 1/20 0.60
GDA Q9Y2T3 1/20 0.56

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
SCHEMBL4384744 0.99 XDH (1.00) XDHPOLA1GDA
SCHEMBL8535457 0.99 XDH (1.00) XDHPOLA1GDA
Hydrochloric Acid SCHEMBL258899 0.97 XDH (0.97) XDHPOLA1GDA
Hydrochloric Acid SCHEMBL30610398 0.96 XDH (0.95) XDHPOLA1GDA
SCHEMBL6272738 0.96 XDH (1.00) XDHPOLA1GDA
Acetic Acid SCHEMBL27671662 0.93 XDH (0.88) XDHPOLA1GDA
SCHEMBL667798 0.90 XDH (0.84) XDHPOLA1GDA
SCHEMBL5935074 0.87 XDH (0.78) XDHPOLA1GDA
SCHEMBL8196752 0.86 XDH (0.76) XDHGDA
SCHEMBL16197989 0.85 XDH (0.77) XDHGDA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-117344022-A Composition for species and human sex identification, kit containing same and application 山西医科大学 2024-01-05 CN disclosed
CN-116949191-A Composition for meat adulteration identification, kit containing composition and application of kit 山西医科大学 2023-10-27 CN disclosed
CN-116234585-A Microtubule-associated protein TAU (MAPT) iRNA agent compositions and methods of use thereof 阿尔尼拉姆医药品有限公司 2023-06-06 CN disclosed
CN-116200476-A Target analyte determination methods, mutant CsgG monomers, constructs, polynucleotides and oligo-wells thereof 牛津纳米孔科技公开有限公司 2023-06-02 CN disclosed
CN-116064734-A Nucleic acid amplification 生命技术公司 2023-05-05 CN disclosed
CN-115298312-A Leucine-rich repeat kinase 2 (LRRK 2) iRNA agent compositions and methods of use thereof 阿尔尼拉姆医药品有限公司 2022-11-04 CN disclosed
CN-114796255-A Application of nicotinamide mononucleotide in protecting liver from being damaged 深圳市旷逸生物科技有限公司 2022-07-29 CN disclosed
CN-114728018-A Huntington (HTT) iRNA pharmaceutical compositions and methods of use thereof 阿尔尼拉姆医药品有限公司 2022-07-08 CN 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-0704445-B1 Preparation of N-9 substituted guanine compounds HOFFMANN LA ROCHE (CH) 1999-04-21 EP disclosed
US-5565565-A Preparation of N-9 substituted guanine compounds SYNTEX (U.S.A.) INC. (US) 1996-10-15 US disclosed
EP-0704445-A1 Preparation of N-9 substituted guanine compounds F. Hoffmann-La Roche AG (CH) 1996-04-03 EP disclosed
EP-0590361-A1 Process for the preparation of 2-amino-6-halopurines BASF Aktiengesellschaft (DE) 1994-04-06 EP disclosed
US-4914131-A HERPES SIMPLEX VIRUS; LIDOCAINE OR ITS SALTS Brigham, Dana P. (US) 1990-04-03 US disclosed
US-4757088-A Administering lidocaine and pantothenic acid; herpes Brigham, Dana P. (US) 1988-07-12 US disclosed
US-4628063-A LIDOCAINE, PANTOTHENOL, HERPES Brigham, Dana P. (US) 1986-12-09 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 (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-20070161582-A1 Pharmaceutical compositions and methods for metabolic modulation GPR119, PRKAG2, PRKAG1 XDH 734/4885POLA1 4465/4885GDA 671/4885
US-20090203638-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION GPR119, PRKAG2, GCKR XDH 726/4885POLA1 4543/4885GDA 656/4885

“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.