SCHEMBL27192243

SCHEMBL27192243

Cn1c(C2CC2)nc2cncc(N)c21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ADORA2A P29274 4/20 0.35
ADORA2B P29275 4/20 0.35
BRD4 O60885 2/20 0.33
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
PARP2 Q9UGN5 1/20 0.33
ABL1 P00519 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
PDE10A Q9Y233 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
SCHEMBL31509801 1.00 PARP1 (0.36) PARP1KDM4EMAPK1HSD17B10L3MBTL1
SCHEMBL30702046 0.94 ADORA2A (0.39) PARP1ADORA2AADORA2BPDE4APDE4B
SCHEMBL27192137 0.94 ADORA2A (0.39) PARP1ADORA2AADORA2BPDE4APDE4B
SCHEMBL27192343 0.81 PARP1 (0.36) PARP1ADORA2AADORA2BBRD4PDE4A
SCHEMBL27191997 0.75 TLR7 (0.39) PARP1ADORA2AADORA2BPDE4APDE4B
SCHEMBL31509758 0.69 ABL1 (0.32) ABL1
SCHEMBL27191841 0.69 PDE4A (0.36) PDE4APDE4BPDE4CPDE4D
SCHEMBL4760283 0.69 ATM (0.50) KDM4EHSD17B10TLR7PDE10A
SCHEMBL27192296 0.69 ABL1 (0.32) ABL1
SCHEMBL30701956 0.68

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 7 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
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 PARP1 1376/4885KDM4E 3744/4885MAPK1 3148/4885
US-12091420-B2 SARS-COV2 main protease inhibitors ACE2, TMPRSS2, ACE PARP1 1376/4885KDM4E 3744/4885MAPK1 3148/4885
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE PARP1 1376/4885KDM4E 3744/4885MAPK1 3148/4885
US-12410183-B2 Sars-cov2 main protease inhibitors ACE2, TMPRSS2, ACE PARP1 1376/4885KDM4E 3744/4885MAPK1 3148/4885
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE PARP1 1376/4885KDM4E 3744/4885MAPK1 3148/4885

“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.