SCHEMBL7570870

SCHEMBL7570870

[Li]c1cc(Br)ccc1F

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
SCHEMBL505542 0.75
SCHEMBL29388695 0.75
SCHEMBL30477974 0.72
Fluoride SCHEMBL27636515 0.72 DGAT1 (0.46)
SCHEMBL2347585 0.72 DGAT1 (0.46)
SCHEMBL2458022 0.72
SCHEMBL321812 0.72
SCHEMBL5078535 0.70 ALOX15 (0.46)
SCHEMBL3606294 0.70
SCHEMBL18009875 0.70 ALOX15 (0.46)

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
CN-1244531-C Process for producing 5-bromo-2-fluorobenzoic boric acid AMERICAN CYANAMID CO (US) 2006-03-08 CN claimed
CN-1403430-A Process for producing 5-bromo-2-fluorobenzoic boric acid AMERICAN CYANAMID CO (US) 2003-03-19 CN claimed
EP-0812847-B1 Process for the preparation of 5-bromo-2-fluorobenzeneboronic acid BASF AG (DE) 2002-09-25 EP claimed
CN-1087743-C Method for preparing 5-bromo-2-fluorobenzeneboronic acid AMERICAN CYANAMID CO (US) 2002-07-17 CN claimed
US-6198008-B1 PREPARATION OF 5-BROMO-2-FLUOROBENZENEBORONIC ACID, USEFUL AS INTERMEDIATE IN PREPARATION OF FLUOROOLEFIN NON-ESTER PYRETHROID PESTICIDE, WHICH AVOIDS USE OF 2,4-DIBROMOFLUOROBENZENE AMERICAN CYANAMID COMPANY 2001-03-06 US claimed
US-5962742-A Process for the preparation of 5-bromo-2 fluorobenzeneboronic acid AMERICAN CYANAMID COMPANY (US) 1999-10-05 US claimed
CN-1168887-A Method for preparing 5-bromo-2-fluorobenzeneboronic acid AMERICAN CYANAMID CO (US) 1997-12-31 CN claimed
EP-0812847-A1 Process for the preparation of 5-bromo-2-fluorobenzeneboronic acid AMERICAN CYANAMID COMPANY (US) 1997-12-17 EP claimed
JP-10059980-A None JP disclosed
US-9198917-B2 Hexahydropyrano[3,4-d][1,3]thiazin-2-amine compounds PFIZER INC. (US) 2015-12-01 US disclosed
EP-2931731-A1 HEXAHYDROPYRANO [3,4-D][1,3]THIAZIN-2-AMINE COMPOUNDS AS INHIBITORS OF BACE1 Pfizer Inc. (US) 2015-10-21 EP disclosed
US-20150231144-A1 Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds PFIZER INC. (US) 2015-08-20 US disclosed
US-9045498-B2 Hexahydropyrano[3,4-d][1,3]thiazin-2-amine compounds PFIZER INC. (US) 2015-06-02 US disclosed
US-20140323474-A1 Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds PFIZER (US) 2014-10-30 US disclosed
CN-1087743-C Method for preparing 5-bromo-2-fluorobenzeneboronic acid AMERICAN CYANAMID CO (US) 2002-07-17 CN disclosed
US-6198008-B1 PREPARATION OF 5-BROMO-2-FLUOROBENZENEBORONIC ACID, USEFUL AS INTERMEDIATE IN PREPARATION OF FLUOROOLEFIN NON-ESTER PYRETHROID PESTICIDE, WHICH AVOIDS USE OF 2,4-DIBROMOFLUOROBENZENE AMERICAN CYANAMID COMPANY 2001-03-06 US disclosed
US-5962742-A Process for the preparation of 5-bromo-2 fluorobenzeneboronic acid AMERICAN CYANAMID COMPANY (US) 1999-10-05 US disclosed
JP-H1059980-A PRODUCTION OF 5-BROMO-2-FLUOROBENZENEBORIC ACID AMERICAN CYANAMID CO 1998-03-03 JP disclosed
CN-1168887-A Method for preparing 5-bromo-2-fluorobenzeneboronic acid AMERICAN CYANAMID CO (US) 1997-12-31 CN disclosed
EP-0812847-A1 Process for the preparation of 5-bromo-2-fluorobenzeneboronic acid AMERICAN CYANAMID COMPANY (US) 1997-12-17 EP disclosed