SCHEMBL26670926

SCHEMBL26670926

CNc1cc2c(cc1[N+](=O)[O-])C(=O)NCC2

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 10/20 0.43
▸ PARP1 P09874 6/20 0.43
▸ PARP11 Q9NR21 6/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPT P10636 5/20 0.41
▸ POLB P06746 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ F7 P08709 1/20 0.40
▸ F3 P13726 1/20 0.40
▸ KMT2A Q03164 1/20 0.38
▸ HCAR3 P49019 1/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ PDPK1 O15530 1/20 0.37
▸ MKNK1 Q9BUB5 1/20 0.36

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
SCHEMBL18875036 0.81 PARP10 (0.50) PARP10PARP1PARP11KDM4EMAPT
SCHEMBL27087781 0.78 KDM4E (0.45) PARP10PARP1PARP11KDM4EMAPT
SCHEMBL17064696 0.78 PARP10 (0.50) PARP10PARP1PARP11KDM4EMAPT
SCHEMBL31510260 0.78 KDM4E (0.45) PARP10PARP1PARP11KDM4EMAPT
SCHEMBL28899149 0.78 ALDH1A1 (0.66) PARP10PARP1PARP11KDM4EMAPT
SCHEMBL27087811 0.78 PARP10 (0.50) PARP10PARP1PARP11KDM4EMAPT
SCHEMBL2205282 0.78 MEN1 (0.48) PARP10PARP1PARP11KDM4EMAPT
SCHEMBL4645824 0.77 PARP10 (0.51) PARP10PARP1PARP11KDM4EF7
SCHEMBL26671057 0.77 PARP10 (0.47) PARP10PARP1PARP11KDM4EF7
SCHEMBL30669000 0.77 PARP10 (0.47) PARP10PARP1PARP11KDM4EF7

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-20250346592-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION 2025-11-13 — — US disclosed
EP-4531849-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2025-04-09 — — EP disclosed
CN-119604287-A Heterocyclic PAD4 inhibitors 细胞基因公司 2025-03-11 — — CN disclosed
WO-2023230609-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2023-11-30 — — WO disclosed
WO-2023230609-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2023-11-30 — — 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 (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-20250346592-A1 HETEROCYCLIC PAD4 INHIBITORS PADI4, PADI6, PADI2 PARP10 291/4885PARP1 68/4885PARP11 186/4885

“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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