SCHEMBL1249908

SCHEMBL1249908

CO[C@H](C)Cn1cnc2c(N)ncnc21

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.69
ADORA1 P30542 5/20 0.69
CYP3A4 P08684 6/20 0.65
PI4KA P42356 3/20 0.60
PI4K2B Q8TCG2 3/20 0.60
PI4K2A Q9BTU6 3/20 0.60
PI4KB Q9UBF8 3/20 0.60
AHCY P23526 3/20 0.59
ADORA2B P29275 2/20 0.57
ALDH1A1 P00352 1/20 0.57
NSD3 Q9BZ95 1/20 0.53
CYP2D6 P10635 5/20 0.53

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
SCHEMBL10015788 1.00 ADORA2A (0.69) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL28883711 0.87 ADORA2A (0.68) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL20502333 0.87 ADORA2A (0.68) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL1249906 0.87 ADORA2A (0.68) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL19831528 0.87 ADORA2A (0.68) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL15045890 0.86 CYP3A4 (0.70) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL3305032 0.85 CYP3A4 (0.68) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL22131060 0.85 ADORA2A (0.64) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL15257613 0.85 CYP3A4 (0.68) ADORA2AADORA1CYP3A4PI4KAPI4K2B
SCHEMBL608687 0.85 CYP3A4 (0.68) ADORA2AADORA1CYP3A4PI4KAPI4K2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974921-B Synthetic tenor Fuwei method 浙江嘉化新材料有限公司 2025-03-14 CN claimed
CN-119431450-A Preparation method of R-9- (2-methoxypropyl) adenine 浙江工业大学 2025-02-14 CN claimed
CN-119185331-A Use of nucleoside reverse transcriptase inhibitors in the preparation of medicaments for preventing and treating premature delivery 上海交通大学医学院附属仁济医院 2024-12-27 CN claimed
CN-118005693-A Preparation method of tenofovir alafenamide fumarate impurity 安徽贝克制药股份有限公司 2024-05-10 CN claimed
CN-115974921-B Synthetic tenor Fuwei method 浙江嘉化新材料有限公司 2025-03-14 CN disclosed
CN-119510597-A Separation and detection method for tenofovir and enantiomer 苏州朗科生物技术股份有限公司 2025-02-25 CN disclosed
CN-119431450-A Preparation method of R-9- (2-methoxypropyl) adenine 浙江工业大学 2025-02-14 CN disclosed
CN-119431450-A Preparation method of R-9- (2-methoxypropyl) adenine 浙江工业大学 2025-02-14 CN disclosed
CN-119431450-A Preparation method of R-9- (2-methoxypropyl) adenine 浙江工业大学 2025-02-14 CN disclosed
CN-119185331-A Use of nucleoside reverse transcriptase inhibitors in the preparation of medicaments for preventing and treating premature delivery 上海交通大学医学院附属仁济医院 2024-12-27 CN disclosed
CN-118159266-A Pharmaceutical combination comprising a capsid protein inhibitor and a reverse transcriptase inhibitor 正大天晴药业集团股份有限公司 2024-06-07 CN disclosed
CN-118005693-A Preparation method of tenofovir alafenamide fumarate impurity 安徽贝克制药股份有限公司 2024-05-10 CN disclosed
US-10092509-B2 Hypotonic microbicidal formulations and methods of use THE JOHNS HOPKINS UNIVERSITY (US) 2018-10-09 US disclosed
WO-2018119013-A1 ANTIVIRAL ALIPHATIC ESTER PRODRUGS OF TENOFOVIR MERCK SHARP & DOHME CORP. (US) 2018-06-28 WO disclosed
EP-3333173-A1 METHODS FOR PREPARING ANTI-VIRAL NUCLEOTIDE ANALOGS Gilead Sciences, Inc. (US) 2018-06-13 EP disclosed
EP-2764002-B1 METHODS FOR PREPARING ANTI-VIRAL NUCLEOTIDE ANALOGS GILEAD SCIENCES INC (US) 2018-02-28 EP disclosed
US-20170119662-A1 HYPOTONIC MICROBICIDAL FORMULATIONS AND METHODS OF USE THE JOHNS HOPKINS UNIVERSITY 2017-05-04 US disclosed
US-20110132376-A1 TOPICAL ANTIVIRAL FORMULATIONS CONRAD (US) 2011-06-09 US disclosed
US-20110120475-A1 TOPICAL ANTIVIRAL FORMULATIONS CONRAD (US) 2011-05-26 US disclosed
EP-2283812-A2 Topical antiviral formulations GILEAD SCIENCES, INC. (US) 2011-02-16 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-20110132376-A1 TOPICAL ANTIVIRAL FORMULATIONS PNP, TYMP, NT5C2 ADORA2A 308/4885ADORA1 234/4885CYP3A4 2475/4885
US-20110120475-A1 TOPICAL ANTIVIRAL FORMULATIONS PNP, TYMP, NT5C2 ADORA2A 308/4885ADORA1 234/4885CYP3A4 2475/4885
US-20170119662-A1 HYPOTONIC MICROBICIDAL FORMULATIONS AND METHODS OF USE SI, SAMHD1, VIP ADORA2A 575/4885ADORA1 348/4885CYP3A4 2268/4885
US-10092509-B2 Hypotonic microbicidal formulations and methods of use SI, SAMHD1, VIP ADORA2A 575/4885ADORA1 348/4885CYP3A4 2268/4885

“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.