SCHEMBL96361

SCHEMBL96361

FCc1c[c]cc(CF)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
SCHEMBL27327455 0.87 LOXL2 (0.32)
SCHEMBL7474126 0.82
SCHEMBL28049287 0.78 GRM5 (0.31)
SCHEMBL28059343 0.77 MEN1 (0.31)
SCHEMBL627374 0.69
SCHEMBL25361911 0.69
SCHEMBL11609185 0.69 TRPA1 (0.36)
SCHEMBL297355 0.69 TP53 (0.36)
SCHEMBL5920890 0.69 ACHE (0.41)
SCHEMBL27972897 0.69 LOXL2 (0.36)

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512843-B1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-10-20 EP claimed
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-10-31 US claimed
EP-3512843-A1 PLANT GROWTH REGULATOR COMPOUNDS Syngenta Participations AG (CH) 2019-07-24 EP claimed
CN-109641883-A PLANT GROWTH REGULATOR COMPOUNDS 先正达参股股份有限公司 2019-04-16 CN claimed
WO-2018050477-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 WO claimed
CN-103189341-B Chiral intermediates useful for the preparation of hydroxyphosphine ligands UNITED PHOSPHORUS LTD 2015-06-17 CN claimed
EP-2635547-A1 CHIRAL INTERMEDIATES USEFUL FOR THE PREPARATION OF HYDROXYPHOSPHINE LIGANDS United Phosphorus Limited (IN) 2013-09-11 EP claimed
US-20130217900-A1 CHIRAL INTERMEDIATES USEFUL FOR THE PREPARATION OF HYDROXYPHOSPHINE LIGANDS UNITED PHOSPHORUS LIMITED (IN) 2013-08-22 US claimed
CN-103189341-A Chiral intermediates useful for the preparation of hydroxyphosphine ligands UNITED PHOSPHORUS LTD 2013-07-03 CN claimed
WO-2012059807-A1 CHIRAL INTERMEDIATES USEFUL FOR THE PREPARATION OF HYDROXYPHOSPHINE LIGANDS UNITED PHOSPHORUS LIMITED (IN) 2012-05-10 WO claimed
CN-101891732-A Cyclic carbonate monomer and preparation method thereof IBM 2010-11-24 CN claimed
US-7294616-B2 Capreomycin derivatives and their use as antibacterials ARRAY BIOPHARMA, INC. (US) 2007-11-13 US claimed
WO-2006052499-A1 CAPREOMYCIN DERIVATIVES AND THEIR USE AS ANTIBACTERIALS ARRAY BIOPHARMA, INC. (US) 2006-05-18 WO claimed
US-20060094644-A1 Capreomycin derivatives and their use as antibacterials ARRAY BIOPHARMA, INC. 2006-05-04 US claimed
US-5712288-A TACHYKININ ANTAGONIST, ANTIINFLAMMATORY, ANTIALLERGEN SANOFI (FR) 1998-01-27 US claimed
US-5646152-A Methods of administering CRF antagonists PFIZER INC. (US) 1997-07-08 US claimed
US-12018003-B2 Substituted pyrimidines as matrix metalloproteinase-9 hemopexin domain inhibitors THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2024-06-25 US disclosed
US-20210309616-A1 SUBSTITUTED QUINAZOLINES AS MATRIX METALLOPROTEINASE-9 HEMOPEXIN DOMAIN INHIBITORS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2021-10-07 US disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO disclosed
CN-1335840-A Novel tetrazolinone derivatives BAYER AGROCHEM KK (JP) 2002-02-13 CN disclosed