SCHEMBL16441111

SCHEMBL16441111

Cc1cc2nc(N)nc(O)c2s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ ADORA2B P29275 2/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ HTT P42858 2/20 0.34
▸ PIK3CA P42336 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ NUDT1 P36639 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.30
▸ TLR7 Q9NYK1 1/20 0.30
▸ HSP90AB1 P08238 1/20 0.30
▸ PDE7A Q13946 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ GAA P10253 1/20 0.30

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
SCHEMBL2537095 0.81 PKM (0.34) SMN1; SMN2ADORA2BPIK3CAPDE7ARAB9A
SCHEMBL18711461 0.81 PIK3CA (0.34) SMN1; SMN2ADORA2BADORA2APIK3CAPDE7A
SCHEMBL21536748 0.81 SMN1; SMN2 (0.39) SMN1; SMN2ADORA2BADORA2AALDH1A1TP53
SCHEMBL5579371 0.81 ALDH1A1 (0.41) SMN1; SMN2ADORA2BADORA2AHTTALDH1A1
SCHEMBL14850021 0.78 PIK3CA (0.33) SMN1; SMN2PIK3CAPDE7A
SCHEMBL23500391 0.78 GAA (0.33) SMN1; SMN2HTTGAAL3MBTL1
SCHEMBL19492381 0.75 ADORA2B (0.35) ADORA2BADORA2APIK3CAPDE7A
SCHEMBL18701516 0.75 ADORA2A (0.32) ADORA2APIK3CA
SCHEMBL18711470 0.75 ADORA2B (0.33) ADORA2BADORA2APIK3CA
SCHEMBL23513918 0.74 KCNH2 (0.34) SMN1; SMN2ADORA2BADORA2APDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3404031-B1 THIENO[3,2-D]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2020-09-23 — — EP disclosed
US-20170298079-A1 THIENO[3,2-d]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UC (IE) 2017-10-19 — — US disclosed
US-20170298079-A1 THIENO[3,2-d]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UC (IE) 2017-10-19 — — US disclosed
US-9556199-B2 Thieno[3,2-d]pyrimidines derivatives for the treatment of viral infections JANSSEN SCIENCES IRELAND UC (IE) 2017-01-31 — — US disclosed
US-9556199-B2 Thieno[3,2-d]pyrimidines derivatives for the treatment of viral infections JANSSEN SCIENCES IRELAND UC (IE) 2017-01-31 — — US disclosed
US-20160168164-A1 THIENO[3,2-d]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UC (IE) 2016-06-16 — — US disclosed
US-20160168164-A1 THIENO[3,2-d]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UC (IE) 2016-06-16 — — US disclosed
WO-2015014815-A1 THIENO[3,2-d]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN R&D IRELAND (IE) 2015-02-05 — — 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 (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-20160168164-A1 THIENO[3,2-d]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS TYMS, TYMP, UMPS SMN1; SMN2 1618/4885ADORA2B 156/4885ADORA2A 139/4885
US-20170298079-A1 THIENO[3,2-d]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS TYMS, TYMP, UMPS SMN1; SMN2 1618/4885ADORA2B 156/4885ADORA2A 139/4885

“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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