SCHEMBL30157293

SCHEMBL30157293

NC(=O)c1cccc2cn(-c3ccc(CNC4CCN(Cc5ccccc5)CC4)cc3)nc12

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 18/20 0.69
PARP2 Q9UGN5 11/20 0.69
PARP3 Q9Y6F1 11/20 0.69
ACHE P22303 2/20 0.52
BACE1 P56817 2/20 0.52
BCHE P06276 1/20 0.52

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
Trifluoroacetic Acid SCHEMBL2263746 0.95 PARP1 (0.63) PARP1PARP2PARP3ACHEBACE1
SCHEMBL30157727 0.95 PARP1 (0.65) PARP1PARP2PARP3ACHEBACE1
Trifluoroacetic Acid SCHEMBL2267877 0.90 PARP1 (0.59) PARP1PARP2PARP3ACHEBACE1
SCHEMBL30157635 0.90 PARP1 (0.68) PARP1PARP2PARP3
SCHEMBL2266716 0.89 PARP1 (0.72) PARP1PARP2PARP3
SCHEMBL30157400 0.87 PARP1 (0.68) PARP1PARP2PARP3
SCHEMBL30875649 0.87 PARP1 (0.66) PARP1PARP2PARP3
SCHEMBL30157638 0.86 PARP1 (0.73) PARP1PARP2PARP3
Trifluoroacetic Acid SCHEMBL2263162 0.85 PARP1 (0.62) PARP1PARP2PARP3
SCHEMBL30157469 0.85 PARP1 (0.64) PARP1PARP2PARP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR FUKANG (SHANGHAI) HEALTH TECHNOLOGY CO., LTD (CN) 2024-01-18 US claimed
EP-4112049-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR Fukang (Shanghai) Health Technology Co., Ltd. (CN) 2023-01-04 EP claimed
CN-113288892-B Use of poly ADP-ribose polymerase inhibitors against coronaviruses 甫康(上海)健康科技有限责任公司 2024-04-26 CN disclosed
US-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR FUKANG (SHANGHAI) HEALTH TECHNOLOGY CO., LTD (CN) 2024-01-18 US disclosed
EP-4112049-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR Fukang (Shanghai) Health Technology Co., Ltd. (CN) 2023-01-04 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 (1 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-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR PARP3, PARP1, PARP4 PARP1 2/4885PARP2 14/4885PARP3 1/4885

“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.