SCHEMBL22912682

SCHEMBL22912682

CCc1cc2ncc(CO)cc2[nH]c1=O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 20/20 0.52
PARP2 Q9UGN5 13/20 0.52
PARP6 Q2NL67 4/20 0.51
PARP3 Q9Y6F1 4/20 0.51
TNKS O95271 1/20 0.51
TIPARP Q7Z3E1 1/20 0.48

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
SCHEMBL29394532 1.00 PARP1 (0.52) PARP1PARP2PARP6PARP3TNKS
SCHEMBL25093486 0.89 PARP1 (0.55) PARP1PARP2PARP6PARP3TNKS
SCHEMBL30064351 0.88 PARP1 (0.50) PARP1PARP2PARP6PARP3TNKS
SCHEMBL22912684 0.85 PARP1 (0.52) PARP1PARP2PARP6PARP3TNKS
SCHEMBL22912763 0.85 PARP1 (0.52) PARP1PARP2PARP6PARP3TNKS
SCHEMBL29396334 0.85 PARP1 (0.52) PARP1PARP2PARP6PARP3TNKS
SCHEMBL29396473 0.85 PARP1 (0.52) PARP1PARP2PARP6PARP3TNKS
SCHEMBL25606984 0.85 PARP1 (0.52) PARP1PARP2PARP6PARP3TNKS
Hydrochloric Acid SCHEMBL29394287 0.84 PARP1 (0.51) PARP1PARP2PARP6PARP3TNKS
Hydrochloric Acid SCHEMBL28702467 0.84 PARP1 (0.51) PARP1PARP2PARP6PARP3TNKS

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025101892-A1 POLY-ADP RIBOSE POLYMERASE (PARP) INHIBITORS AND USES THEREOF Astellas Engineered Small Molecules US, Incorporated (US) 2025-05-15 WO disclosed
WO-2025040767-A1 2-(3,8-DIAZABICYCLO[3.2.1]OCTAN-3-YL)-1,3,5-TRIAZINE DERIVATIVES AS KRAS G12D INHIBITORS FOR THE TREATMENT OF CANCER SANOFI (FR) 2025-02-27 WO disclosed
US-20240228490-A1 HETEROCYCLIC DERIVATIVE INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2024-07-11 US disclosed
US-12006314-B2 Anti-cancer nuclear hormone receptor-targeting compounds NUVATION BIO INC. (US) 2024-06-11 US disclosed
CN-118139862-A Nitrogen-containing heterocyclic compound and medical application thereof 中国医药研究开发中心有限公司 2024-06-04 CN disclosed
CN-118119629-A Nitrogen-containing heterocyclic compound and medical application thereof 中国医药研究开发中心有限公司 2024-05-31 CN disclosed
US-20240132522-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. 2024-04-25 US disclosed
EP-4334314-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS Nuvation Bio Inc. (US) 2024-03-13 EP disclosed
EP-4328224-A1 PARP INHIBITOR CONTAINING PIPERAZINE STRUCTURE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2024-02-28 EP disclosed
EP-4328225-A1 HETEROCYCLIC DERIVATIVE INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2024-02-28 EP disclosed
CN-116143776-A PARP1 inhibitor and application thereof 南京圣和药业股份有限公司 2023-05-23 CN disclosed
WO-2023046158-A1 AZAQUINOLINONE COMPOUND AND MEDICAL USE THEREOF 张文燕 2023-03-30 WO disclosed
US-20220380364-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2022-12-01 US disclosed
WO-2022235585-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NUVATION BIO INC. (US) 2022-11-10 WO disclosed
CN-115260189-A Synthetic method of 3-ethyl-7- (hydroxymethyl) -1,5-naphthyridin-2 (1H) -ketone 爱斯特(成都)生物制药股份有限公司 2022-11-01 CN disclosed
WO-2022222995-A1 PICOLINAMIDE COMPOUND 南京明德新药研发有限公司 2022-10-27 WO disclosed
US-11325906-B2 Chemical compounds ASTRAZENECA AB (SE) 2022-05-10 US disclosed
WO-2022074617-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND PARP1 SELECTIVE INHIBITOR ASTRAZENECA UK LIMITED (GB) 2022-04-14 WO disclosed
US-20210040084-A1 CHEMICAL COMPOUNDS ASTRAZENECA UK LIMITED (GB) 2021-02-11 US disclosed
WO-2021013735-A1 PARP1 INHIBITORS ASTRAZENECA AB (SE) 2021-01-28 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 (6 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-20220380364-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NCOA1, NCOR1, NCOA3 PARP1 1873/4885PARP2 1805/4885PARP6 1162/4885
US-12006314-B2 Anti-cancer nuclear hormone receptor-targeting compounds NR5A1, NCOA1, NR5A2 PARP1 3839/4885PARP2 4136/4885PARP6 3330/4885
US-20210040084-A1 CHEMICAL COMPOUNDS CYP11B2, CYP11B1, CYP4B1 PARP1 399/4885PARP2 586/4885PARP6 600/4885
US-20240228490-A1 HETEROCYCLIC DERIVATIVE INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF WEE1, CYP51A1, WEE2 PARP1 1119/4885PARP2 2032/4885PARP6 965/4885
US-20240132522-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF PARP1, PARP11, PARP12 PARP1 1/4885PARP2 4/4885PARP6 10/4885
US-11325906-B2 Chemical compounds CYP11B2, CYP11B1, CYP4B1 PARP1 399/4885PARP2 586/4885PARP6 600/4885

“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.