SCHEMBL21536698

SCHEMBL21536698

CCCC(Nc1nc(N)nc2ccsc12)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 4/20 0.41
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ ADORA1 P30542 2/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ DRD1 P21728 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ ADORA2A P29274 2/20 0.39
▸ ADORA2B P29275 1/20 0.39
▸ KCNH2 Q12809 9/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TLR7 Q9NYK1 4/20 0.38

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
SCHEMBL17829981 1.00 TLR8 (0.41) TLR8PDE4APDE4BPDE4CPDE4D
SCHEMBL17829984 0.79 TLR8 (0.56) TLR8PDE4APDE4BPDE4CPDE4D
SCHEMBL17829978 0.79 TLR8 (0.60) TLR8ADORA1CYP2D6DRD1HTR2A
SCHEMBL17829988 0.79 TLR8 (0.60) TLR8ADORA1CYP2D6DRD1HTR2A
SCHEMBL22448318 0.79 TLR8 (0.36) TLR8CYP2D6ADORA2AKCNH2TLR7
SCHEMBL17829992 0.79 TLR8 (0.36) TLR8CYP2D6ADORA2AKCNH2TLR7
SCHEMBL21536319 0.78 KCNH2 (0.63) TLR8ADORA1CYP2D6DRD1HTR2A
SCHEMBL18109621 0.76 TLR8 (0.70) TLR8ADORA1CYP2D6DRD1HTR2A
SCHEMBL18109622 0.76 TLR8 (0.70) TLR8ADORA1CYP2D6DRD1HTR2A
SCHEMBL17829986 0.74 TLR8 (0.64) TLR8KCNH2TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10822347-B2 Thieno[3,2-d]pyrimidines derivatives for the treatment of viral infections Janssen Sciences Ireland Unlimited Company (IE) 2020-11-03 — — US disclosed
US-20190330227-A1 THIENO[3,2-D]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UC (IE) 2019-10-31 — — 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-20190330227-A1 THIENO[3,2-D]PYRIMIDINES DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS TYMS, TYMP, UMPS TLR8 1457/4885PDE4A 734/4885PDE4B 706/4885
US-10822347-B2 Thieno[3,2-d]pyrimidines derivatives for the treatment of viral infections TYMS, TYMP, UMPS TLR8 1457/4885PDE4A 734/4885PDE4B 706/4885

“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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