SCHEMBL7759919

SCHEMBL7759919

O=[N+]([O-])C1=CCC(F)(Br)C=C1

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
SCHEMBL15399539 0.78
SCHEMBL4754696 0.78
SCHEMBL23357784 0.78
SCHEMBL8813249 0.78
SCHEMBL10626473 0.74
SCHEMBL17136152 0.73
SCHEMBL9711596 0.70
SCHEMBL9763476 0.70 CYP19A1 (0.30)
SCHEMBL7918141 0.70
SCHEMBL4953742 0.70

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-3162802-B1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICINE CONTAINING SAME NIHON MEDIPHYSICS CO LTD (JP) 2020-08-19 EP disclosed
CN-106458995-B 2- (3-pyridyl) -1H-benzimidazole derivative compound and medicine containing the same 日本医事物理股份有限公司 2019-12-20 CN disclosed
US-10358434-B2 2-(3-pyridinyl)-1H-benzimidazole derivative compound and medicament containing same NIHON MEDI-PHYSICS CO., LTD. (JP) 2019-07-23 US disclosed
US-20190169169-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICAMENT CONTAINING SAME NIHON MEDI-PHYSICS CO., LTD. (JP) 2019-06-06 US disclosed
US-10189815-B2 2-(3-pyridinyl)-1H-benzimidazole derivative compound and medicine containing same NIHON MEDI-PHYSICS CO., LTD. (JP) 2019-01-29 US disclosed
US-20170158668-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICINE CONTAINING SAME NIHON MEDI-PHYSICS CO., LTD. (JP) 2017-06-08 US disclosed
EP-3162802-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICINE CONTAINING SAME Nihon Medi-Physics Co., Ltd. (JP) 2017-05-03 EP disclosed
EP-0721441-B1 HALOGENATION REACTIONS F2 CHEMICALS LTD (GB) 2001-04-04 EP disclosed
US-5734073-A Halogenation reactions BNFL FLUOROCHEMICALS LTD (GB) 1998-03-31 US disclosed