SCHEMBL27191997

SCHEMBL27191997

Cn1c(C2CCC2)nc2cncc(Br)c21

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.39
ADORA2A P29274 4/20 0.39
ADORA2B P29275 4/20 0.39
PDE4A P27815 2/20 0.36
PDE4B Q07343 2/20 0.36
PDE4C Q08493 2/20 0.36
PDE4D Q08499 2/20 0.36
PARP1 P09874 5/20 0.35
ABL1 P00519 1/20 0.35
RPS6KA5 O75582 1/20 0.33
PARP2 Q9UGN5 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL27192343 0.94 PARP1 (0.36) TLR7ADORA2AADORA2BPDE4APDE4B
SCHEMBL27192137 0.82 ADORA2A (0.39) TLR7ADORA2AADORA2BPDE4APDE4B
SCHEMBL30702046 0.82 ADORA2A (0.39) TLR7ADORA2AADORA2BPDE4APDE4B
SCHEMBL27192243 0.75 PARP1 (0.36) TLR7ADORA2AADORA2BPDE4APDE4B
SCHEMBL31509801 0.75 PARP1 (0.36) TLR7ADORA2AADORA2BPDE4APDE4B
SCHEMBL27191761 0.72 RPS6KA5 (0.40) RPS6KA5
SCHEMBL31580070 0.70 SMN1; SMN2 (0.40) RPS6KA5
SCHEMBL9215234 0.70 TLR7 (0.64) TLR7ADORA2AADORA2BKMT2A
SCHEMBL27192413 0.67 RPS6KA5 (0.35) ABL1RPS6KA5
SCHEMBL27192086 0.67 PDE4A (0.36) PDE4APDE4BPDE4CPDE4DRPS6KA5

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
US-12410183-B2 Sars-cov2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2025-09-09 US disclosed
EP-4565574-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2025-06-11 EP disclosed
CN-119731159-A SARS-CoV2 main proteinase inhibitor 吉利德科学公司 2025-03-28 CN disclosed
US-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2025-02-06 US disclosed
US-12091420-B2 SARS-COV2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2024-09-17 US disclosed
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-07-18 US disclosed
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-04-11 US disclosed
WO-2024031089-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2024-02-08 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 (5 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-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE TLR7 4551/4885ADORA2A 4464/4885ADORA2B 4603/4885
US-12091420-B2 SARS-COV2 main protease inhibitors ACE2, TMPRSS2, ACE TLR7 4551/4885ADORA2A 4464/4885ADORA2B 4603/4885
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE TLR7 4551/4885ADORA2A 4464/4885ADORA2B 4603/4885
US-12410183-B2 Sars-cov2 main protease inhibitors ACE2, TMPRSS2, ACE TLR7 4551/4885ADORA2A 4464/4885ADORA2B 4603/4885
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE TLR7 4551/4885ADORA2A 4464/4885ADORA2B 4603/4885

“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.