SCHEMBL25224764

SCHEMBL25224764

NC1CCOc2scnc21

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
SCHEMBL24075136 0.78
SCHEMBL25222941 0.78 MAP3K14 (0.32)
SCHEMBL24090508 0.74
SCHEMBL25203490 0.70 P2RX7 (0.42)
SCHEMBL25221343 0.70
SCHEMBL25207090 0.67 L3MBTL1 (0.31)
Hydrochloric Acid SCHEMBL29754417 0.65 DRD2 (0.33)
SCHEMBL5054785 0.62 CXCR4 (0.38)
SCHEMBL5051454 0.62 CXCR4 (0.38)
SCHEMBL31482094 0.62 CXCR4 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4426699-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS Boehringer Ingelheim Vetmedica GmbH (DE) 2024-09-11 EP disclosed
US-20240254133-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2024-08-01 US disclosed
CN-118339164-A Insect repellent pyrrolopyridazine compounds 勃林格殷格翰动物保健有限公司 2024-07-12 CN disclosed
US-11999742-B2 Substituted pyrrolo[1,2-b]pyridazines as anthelmintics BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2024-06-04 US disclosed
WO-2023073641-A9 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2024-02-29 WO disclosed
US-20230159543-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2023-05-25 US disclosed
US-20230159543-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2023-05-25 US disclosed
US-20230159543-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2023-05-25 US disclosed
WO-2023073641-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2023-05-04 WO disclosed