SCHEMBL8215936

SCHEMBL8215936

Nc1nc(Cl)nc2c1ncn2[C@@H]1S[C@H](CO)[C@@H](O)[C@@H]1F

nearest known ligand 0.81

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 10/20 0.62
▸ ADORA2A P29274 5/20 0.62
▸ ADORA1 P30542 4/20 0.62
▸ PDE2A O00408 3/20 0.62
▸ PDE4D Q08499 2/20 0.62
▸ PDE3A Q14432 2/20 0.62
▸ ADRA1A P35348 1/20 0.62
▸ PNP P00491 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.52
▸ HSP90AA1 P07900 1/20 0.51
▸ HSP90B1 P14625 1/20 0.51
▸ TMEM97 Q5BJF2 1/20 0.48
▸ SIGMAR1 Q99720 1/20 0.48
▸ NT5E P21589 3/20 0.48
▸ CD99 P14209 1/20 0.48

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
SCHEMBL8215939 1.00 ADORA3 (0.62) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL3740994 0.90 ADORA3 (0.63) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL7768864 0.90 ADORA3 (0.63) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL14518668 0.90 ADORA3 (0.63) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL3746582 0.90 ADORA3 (0.63) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL3740999 0.90 ADORA3 (0.63) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL5361537 0.90 ADORA3 (0.63) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL8216884 0.88 AHCY (0.58) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL8215986 0.88 AHCY (0.55) ADORA3ADORA2AADORA1PDE2APDE4D
SCHEMBL8216887 0.88 AHCY (0.58) ADORA3ADORA2AADORA1PDE2APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6103707-A TREATMENT OF HERPES SIMPLEX VIRUS 1 (HSV-1), HERPES SIMPLEX VIRUS 2 (HSV-2), HUMAN CYTOMEGALOVIRUS (HCMV) AND VARICELLA-ZOSTER VIRUS YAMASA CORPORATION (JP) 2000-08-15 — — US claimed
EP-0839813-A1 9-(2-DEOXY-2-FLUORO-4-THIO-BETA-D-ARABINOFURANOSYL)PURINE DERIVATIVES YAMASA CORPORATION (JP) 1998-05-06 — — EP claimed
EP-3279207-B1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF SICHUAN KELUN BIOTECH BIOPHARMACEUTICAL CO LTD (CN) 2024-01-24 — — EP disclosed
US-20200262860-A1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2020-08-20 — — US disclosed
US-10662214-B2 Compound of 4′-thionucleoside, as well as preparation method therefor, pharmaceutical composition thereof and application thereof Sichuan Keiun-Biotech Biopharmaceutical Co., Ltd. (CN) 2020-05-26 — — US disclosed
US-20180079770-A1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2018-03-22 — — US disclosed
EP-3279207-A1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2018-02-07 — — EP disclosed
US-6103707-A TREATMENT OF HERPES SIMPLEX VIRUS 1 (HSV-1), HERPES SIMPLEX VIRUS 2 (HSV-2), HUMAN CYTOMEGALOVIRUS (HCMV) AND VARICELLA-ZOSTER VIRUS YAMASA CORPORATION (JP) 2000-08-15 — — US disclosed
EP-0839813-A1 9-(2-DEOXY-2-FLUORO-4-THIO-BETA-D-ARABINOFURANOSYL)PURINE DERIVATIVES YAMASA CORPORATION (JP) 1998-05-06 — — 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 (3 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-10662214-B2 Compound of 4′-thionucleoside, as well as preparation method therefor, pharmaceutical composition thereof and application thereof TYMP, WEE1, NTPCR ADORA3 1448/4885ADORA2A 1791/4885ADORA1 632/4885
US-20180079770-A1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF WEE1, WEE2, THEM6 ADORA3 2076/4885ADORA2A 2445/4885ADORA1 950/4885
US-20200262860-A1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF GOT1, SLC39A11, TYMP ADORA3 2107/4885ADORA2A 3702/4885ADORA1 1909/4885

“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.

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