SCHEMBL78211

SCHEMBL78211

Oc1c(F)c(F)cc(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.43
CA2 P00918 3/20 0.43
CA4 P22748 2/20 0.43
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
CA12 O43570 2/20 0.38
CA7 P43166 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
HSD17B1 P14061 6/20 0.35
HSD17B2 P37059 6/20 0.35
CA9 Q16790 2/20 0.35
CA3 P07451 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
SELL P14151 1/20 0.33
SELP P16109 1/20 0.33
SELE P16581 1/20 0.33
ERN1 O75460 1/20 0.33

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
Cyanide SCHEMBL28063240 0.91 CA1 (0.39) CA1CA2CA4CES2CES1
SCHEMBL5510282 0.87 CA1 (0.40) CA1CA2CA4CES2CES1
SCHEMBL515819 0.84 CES2 (0.36) CA1CA2CA4CES2CES1
SCHEMBL11589756 0.82 HSD17B1 (0.39) CA1CA2CA4CES2CES1
SCHEMBL12459470 0.82 CA1 (0.37) CA1CA2CA4CES2CES1
SCHEMBL31150397 0.82 HSD17B1 (0.39) CA1CA2CA4CES2CES1
Phenol SCHEMBL21753938 0.82 CA12 (0.52) CA1CA2CA4CA12HSD17B1
SCHEMBL5514095 0.80 CES2 (0.38) CA1CA2CA4CES2CES1
SCHEMBL30367972 0.80 CA1 (0.40) CA1CA2CA4CES2CES1
SCHEMBL2396959 0.80 CA1 (0.40) CA1CA2CA4CES2CES1

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

Appears in 2127 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250382646-A1 ENGINEERED ENZYMES AND METHODS FOR THE SYNTHESIS OF DIVERSE TYROSINE ANALOGS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2025-12-18 US claimed
EP-4649966-A2 RADIOLABELED ANTI-PD-L1 ANTIBODIES FOR IMMUNO-PET IMAGING Regeneron Pharmaceuticals, Inc. (US) 2025-11-19 EP claimed
US-12421534-B2 Engineered enzymes and method for the synthesis of diverse tyrosine analogs CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2025-09-23 US claimed
CN-119873775-A Method for removing industrial waste salt organic matters and synchronously realizing high-value conversion 中国科学院生态环境研究中心 2025-04-25 CN claimed
CN-119684090-A Preparation method of 2,3,5, 6-tetrafluorophenol 阜新睿光氟化学有限公司 2025-03-25 CN claimed
WO-2025040093-A1 MOLECULAR PROBES TARGETING GPC3 AND USE THEREOF 武汉睿迪辐生物科技有限公司 2025-02-27 WO claimed
CN-119499408-A Molecular probes targeting GPC3 and uses 武汉睿迪辐生物科技有限公司 2025-02-25 CN claimed
US-20240409637-A1 ANTI-CD8 ANTIBODIES AND USES THEREOF REGENERON PHARMACEUTICALS, INC. 2024-12-12 US claimed
CN-119080627-A Synthesis method of roxburgh Bei Kao shake 江苏慧聚药业股份有限公司 2024-12-06 CN claimed
CN-118598750-A Fluorine-containing active ester compound and preparation method and application thereof 广东工业大学 2024-09-06 CN claimed
US-5081208-A Using a catalyst system comprising the reaction product of a tungsten compound and a halo- or trihalomethylphenol and a trihydrocarbyltin hydride; RIM; kinetics SHELL OIL COMPANY (US) 1992-01-14 US claimed
US-5081014-A Oxidation to produce hydrogen peroxide which ionizes a fluorine compound, titration of ionic fluorine, NADH or nadph HOFFMANN-LA ROCHE INC. (US) 1992-01-14 US claimed
EP-0392384-A2 Targeted forms of methyltrithio antitumor agents AMERICAN CYANAMID COMPANY (US) 1990-10-17 EP claimed
EP-0336486-A2 Polymerization of norbornene derivatives and catalytic system suitable for use therein SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-10-11 EP claimed
EP-0313873-A1 Targeted forms of methyltrithio antitumor agents AMERICAN CYANAMID COMPANY (US) 1989-05-03 EP claimed
US-4572805-A REACTING CYANO-SUBSTITUTED OR UNSUBSTITUTED 2,3,5,6-TETRAFLUORO PHENOLS WITH ACRYLOYL OR METHACRYLOYL CHLORIDE NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1986-02-25 US claimed
EP-0020623-B1 ANALYTICAL PROCESS AND MEANS FOR MEASURING THE AMOUNT OF HYDROGEN PEROXIDE IN AQUEOUS MEDIA AND OF ORGANIC SUBSTRATES GENERATING HYDROGEN PEROXIDE BY ENZYMATIC OXIDATION BATTELLE MEMORIAL INSTITUTE (CH) 1982-12-22 EP claimed
US-4353983-A ELECTROCHEMISTRY BATTELLE MEMORIAL INSTITUTE (CH) 1982-10-12 US claimed
EP-0020623-A1 ANALYTICAL PROCESS AND MEANS FOR MEASURING THE AMOUNT OF HYDROGEN PEROXIDE IN AQUEOUS MEDIA AND OF ORGANIC SUBSTRATES GENERATING HYDROGEN PEROXIDE BY ENZYMATIC OXIDATION. BATTELLE MEMORIAL INSTITUTE (CH) 1981-01-07 EP claimed
WO-1980001081-A1 ANALYTICAL PROCESS AND MEANS FOR MEASURING THE AMOUNT OF HYDROGEN PEROXIDE IN AQUEOUS MEDIA AND OF ORGANIC SUBSTRATES GENERATING HYDROGEN PEROXIDE BY ENZYMATIC OXIDATION BATTELLE MEMORIAL INSTITUTE (CH) 1980-05-29 WO claimed