SCHEMBL25408486

SCHEMBL25408486

O=C(O)c1[nH]ncc1F

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL25410167 0.80
SCHEMBL10957711 0.74
SCHEMBL5134164 0.74 IL1B (0.45)
SCHEMBL15850527 0.73
SCHEMBL20929052 0.73
SCHEMBL1974907 0.73
SCHEMBL6822905 0.73
SCHEMBL4837697 0.73
SCHEMBL1973618 0.73
SCHEMBL12943882 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250215013-A1 SUBSTITUTED TRICYCLIC COMPOUNDS AS PARP INHIBITORS AND THE USE THEREOF IMPACT THERAPEUTICS (SHANGHAI), INC. (CN) 2025-07-03 US disclosed
WO-2025057114-A1 PARP1 INHIBITORS AND THE USE IN THE TREATMENT OF CNS DISEASES IMPACT THERAPEUTICS (SHANGHAI), INC. (CN) 2025-03-20 WO disclosed
EP-4490161-A1 SUBSTITUTED TRICYCLIC COMPOUNDS AS PARP INHIBITORS AND THE USE THEREOF Impact Therapeutics (Shanghai), Inc. (CN) 2025-01-15 EP disclosed
CN-119013279-A Substituted tricyclic compounds as PARP inhibitors and uses thereof 上海瑛派药业有限公司 2024-11-22 CN disclosed
US-20230348473-A1 SUBSTITUTED PYRIDINES AS PARP1 INHIBITORS XINTHERA, INC. 2023-11-02 US disclosed
US-20230348473-A1 SUBSTITUTED PYRIDINES AS PARP1 INHIBITORS XINTHERA, INC. 2023-11-02 US disclosed
WO-2023212219-A1 TRICYCLIC PARP1 INHIBITORS AND USES THEREOF XINTHERA, INC. (US) 2023-11-02 WO disclosed
US-11802128-B2 Azetidine and pyrrolidine PARP1 inhibitors and uses thereof XINTHERA, INC. (US) 2023-10-31 US disclosed
US-11802128-B2 Azetidine and pyrrolidine PARP1 inhibitors and uses thereof XINTHERA, INC. (US) 2023-10-31 US disclosed
US-11795173-B1 Substituted pyridines as PARP1 inhibitors XINTHERA, INC. (US) 2023-10-24 US disclosed
US-11795173-B1 Substituted pyridines as PARP1 inhibitors XINTHERA, INC. (US) 2023-10-24 US disclosed
WO-2023169226-A1 SUBSTITUTED TRICYCLIC COMPOUNDS AS PARP INHIBITORS AND THE USE THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2023-09-14 WO disclosed
US-20230203033-A1 AZETIDINE AND PYRROLIDINE PARP1 INHIBITORS AND USES THEREOF XINTHERA, INC. 2023-06-29 US disclosed
US-20230203033-A1 AZETIDINE AND PYRROLIDINE PARP1 INHIBITORS AND USES THEREOF XINTHERA, INC. 2023-06-29 US disclosed
US-20230159525-A1 AZETIDINE AND PYRROLIDINE PARP1 INHIBITORS AND USES THEREOF XINTHERA, INC. 2023-05-25 US disclosed
CN-114555609-A Macrocyclic sulfonamide derivatives useful as NLRP3 inhibitors 英夫拉索姆有限公司 2022-05-27 CN disclosed