SCHEMBL441131

SCHEMBL441131

O=Cc1c(F)c(F)cc(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA12 O43570 2/20 0.44
CA7 P43166 1/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA4 P22748 2/20 0.39
CES2 O00748 2/20 0.36
CES1 P23141 2/20 0.36
ALDH1A1 P00352 2/20 0.35
ERN1 O75460 3/20 0.34
CA9 Q16790 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL8684580 0.88 CA1 (0.41) CA1CA2CA12CA7CA13
SCHEMBL10497746 0.83 CA1 (0.41) CA1CA2CA12CA7CA13
SCHEMBL3716072 0.83 CA12 (0.37) CA1CA2CA12CA7CA13
SCHEMBL4746715 0.83 ERN1 (0.35) CA1CA2CA12CA7CA13
SCHEMBL31178943 0.83 CA1 (0.37) CA1CA2CA12CA7CA13
SCHEMBL3969020 0.83 ERN1 (0.47) CA1CA2CA12CA7CA13
SCHEMBL18526977 0.83 ERN1 (0.38) CA1CA2CA12CA7CA13
SCHEMBL9478821 0.83 CA1 (0.37) CA1CA2CA12CA7CA13
SCHEMBL31015984 0.83 CA1 (0.37) CA1CA2CA12CA7CA13
SCHEMBL28273088 0.83 CA1 (0.37) CA1CA2CA12CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119424664-A Tumor microenvironment response pharmaceutical composition and preparation method and application thereof 北京大学 2025-02-14 CN claimed
CN-118258793-A COF-phenylboronic acid hydrogel sensing chip and preparation method and application thereof 国家纳米科学中心 2024-06-28 CN claimed
CN-118165200-A Magnetically modified fluorinated covalent organic framework material and application thereof 中国科学院大连化学物理研究所 2024-06-11 CN claimed
CN-117181301-A Fluorinated COFs finite-domain Pd nanocluster photocatalyst and preparation method and application thereof 北京大学 2023-12-08 CN claimed
CN-114751807-B Preparation process of 2,3,5, 6-tetrafluorobenzyl alcohol 忠同科技(大连)有限公司 2023-08-22 CN claimed
CN-114751807-A Novel efficient preparation process of 2,3,5, 6-tetrafluorobenzyl alcohol 忠同科技(大连)有限公司 2022-07-15 CN claimed
CN-113842901-A Sea urchin-shaped MOFs @ COFs core-shell structure material and preparation method and application thereof 广东省科学院测试分析研究所(中国广州分析测试中心) 2021-12-28 CN claimed
CN-113717337-A Magnetic fluorinated covalent organic framework material and preparation method and application thereof 山东省分析测试中心 2021-11-30 CN claimed
CN-113292399-B Synthetic method of transfluthrin intermediate 浙江中欣氟材股份有限公司 2021-11-26 CN claimed
CN-113522244-A Covalent organic framework composite material and preparation method and application thereof 广东工业大学 2021-10-22 CN claimed
EP-1381359-A1 AURONES AS TELOMERASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-01-21 EP claimed
US-6624336-B1 Acetalization of tetrafluorobenzonitriles using alcohols, in the presence of mineral acids and metal catalysts to form chemical intermediates for nontoxic insecticides SHOWA DENKO K.K. (JP) 2003-09-23 US claimed
WO-2002083123-A1 AURONES AS TELOMERASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2002-10-24 WO claimed
US-20020146633-A1 FLUORINATED AROMATIC ACETAL POLYMERS AND PHOTOSENSITIVE COMPOSITIONS CONTAINING SUCH POLYMERS KODAK POLYCHROME GRAPHICS L.L.C. 2002-10-10 US claimed
US-6458503-B1 BLEND WITH DIAZO RESIN; LITHOGRAPHIC PRINTING PLATES; PHOTOPOLYMERIZATION AND CROSSLINKING KODAK POLYCHROME GRAPHICS LLC 2002-10-01 US claimed
WO-2002073315-A1 FLUORINATED AROMATIC ACETAL POLYMERS AND PHOTOSENSITIVE COMPOSITIONS CONTAINING SUCH POLYMERS KODAK POLYCHROME GRAPHICS COMPANY, LTD. (US) 2002-09-19 WO claimed
EP-1182184-A1 PROCESS FOR PRODUCING TETRAFLUORO BENZENEMETHANOLS Showa Denko K K (JP) 2002-02-27 EP claimed
US-5931995-A Ink compositions XEROX CORPORATION (US) 1999-08-03 US claimed
EP-0725787-A1 ACTIVATED NUCLEOSIDE PHOSPHORAMIDITES AND METHODS FOR THE PREPARATION AND USE THEREOF BECKMAN INSTRUMENTS, INC. (US) 1996-08-14 EP claimed
WO-1996006853-A1 ACTIVATED NUCLEOSIDE PHOSPHORAMIDITES AND METHODS FOR THE PREPARATION AND USE THEREOF BECKMAN INSTRUMENTS, INC. (US) 1996-03-07 WO claimed