SCHEMBL810975

SCHEMBL810975

CC(=O)C(F)(F)C(C)(F)F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL10053403 0.82 LMNA (0.39) LMNATSHR
SCHEMBL13227921 0.81 THRB (0.31)
SCHEMBL27599533 0.79 THRB (0.35)
SCHEMBL16589114 0.78 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL18017012 0.77 THRB (0.39)
SCHEMBL18017021 0.77 THRB (0.39)
SCHEMBL18017019 0.77 THRB (0.39)
SCHEMBL18017014 0.77 THRB (0.39)
SCHEMBL18017024 0.77 THRB (0.39)
SCHEMBL18017015 0.77 THRB (0.39)

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2922836-B1 NEW NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO)MOLECULES; PRECURSORS AND CONJUGATES THEREOF ADVANCED ACCELERATOR APPLICATIONS (FR) 2019-07-10 EP disclosed
US-20190119316-A1 NEW NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO)MOLECULES; PRECURSORS AND CONJUGATES THEREOF ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2019-04-25 US disclosed
US-10196421-B2 Nucleophile-reactive sulfonated compounds for the (radio)labelling of (bio)molecules; precursors and conjugates thereof ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2019-02-05 US disclosed
EP-2399895-B1 Process for producing optically active aliphatic fluoroalcohol KANTO KAGAKU (JP) 2018-08-08 EP disclosed
US-9802963-B2 Fluorine-containing complex compound, and production method for fluorine-containing organic compound employing same DAIKIN INDUSTRIES, LTD. (JP) 2017-10-31 US disclosed
US-20170158731-A1 NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO)MOLECULES; PRECURSORS AND CONJUGATES THEREOF ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2017-06-08 US disclosed
US-20170158731-A1 NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO)MOLECULES; PRECURSORS AND CONJUGATES THEREOF ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2017-06-08 US disclosed
US-9611215-B2 Nucleophile-reactive sulfonated compounds for the (radio)labelling of (bio) molecules; precursors and conjugates thereof ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2017-04-04 US disclosed
US-9611215-B2 Nucleophile-reactive sulfonated compounds for the (radio)labelling of (bio) molecules; precursors and conjugates thereof ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2017-04-04 US disclosed
US-20160214999-A1 FLUORINE-CONTAINING COMPLEX COMPOUND, AND PRODUCTION METHOD FOR FLUORINE-CONTAINING ORGANIC COMPOUND EMPLOYING SAME DAIKIN INDUSTRIES, LTD. (JP) 2016-07-28 US disclosed
US-20150284326-A1 NEW NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO) MOLECULES; PRECURSORS AND CONJUGATES THEREOF ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2015-10-08 US disclosed
US-20150284326-A1 NEW NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO) MOLECULES; PRECURSORS AND CONJUGATES THEREOF ADVANCED ACCELERATOR APPLICATIONS SA (FR) 2015-10-08 US disclosed
US-9101635-B2 Inhibitors of filovirus entry into host cells MICROBIOTIX, INC. (US) 2015-08-11 US disclosed
US-8558033-B2 Process for producing optically active aliphatic fluoroalcohol KANTO KAGAKU KABUSHIKI KAISHA (JP) 2013-10-15 US disclosed
US-8314141-B2 Inhibitors of serine proteases, particularly hepatitis C virus NS3 protease VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-11-20 US disclosed
US-20120189614-A1 INHIBITORS OF FILOVIRUS ENTRY INTO HOST CELLS Crobiotix, Inc. (US) 2012-07-26 US disclosed
US-20110319671-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALIPHATIC FLUOROALCOHOL KANTO KAGAKU KABUSHIKI KAISHA (JP) 2011-12-29 US disclosed
EP-2399895-A2 Process for producing optically active aliphatic fluoroalcohol Kanto Kagaku Kabushiki Kaisha (JP) 2011-12-28 EP disclosed
US-20090143312-A1 INHIBITORS OF SERINE PROTEASES, PARTICULARLY HEPATITIS C VIRUS NS3 PROTEASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-06-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120189614-A1 INHIBITORS OF FILOVIRUS ENTRY INTO HOST CELLS BSG, SLCO1B3, SLCO2B1 LMNA 1385/4885GAA 618/4885ALDH1A1 1308/4885
US-20190119316-A1 NEW NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO)MOLECULES; PRECURSORS AND CONJUGATES THEREOF TST, STS, SULT1E1 LMNA 4325/4885GAA 2455/4885ALDH1A1 541/4885
US-20170158731-A1 NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO)MOLECULES; PRECURSORS AND CONJUGATES THEREOF SULT1E1, TST, SULT1A1 LMNA 3021/4885GAA 2402/4885ALDH1A1 285/4885
US-20150284326-A1 NEW NUCLEOPHILE-REACTIVE SULFONATED COMPOUNDS FOR THE (RADIO)LABELLING OF (BIO) MOLECULES; PRECURSORS AND CONJUGATES THEREOF SULT1E1, SULT1A1, TST LMNA 3381/4885GAA 2400/4885ALDH1A1 211/4885
US-20090143312-A1 INHIBITORS OF SERINE PROTEASES, PARTICULARLY HEPATITIS C VIRUS NS3 PROTEASE HPN, PRSS1, PRSS3 LMNA 2150/4885GAA 568/4885ALDH1A1 3201/4885
US-20160214999-A1 FLUORINE-CONTAINING COMPLEX COMPOUND, AND PRODUCTION METHOD FOR FLUORINE-CONTAINING ORGANIC COMPOUND EMPLOYING SAME AFF1, AFF2, AFF4 LMNA 4791/4885GAA 3965/4885ALDH1A1 1452/4885
US-10196421-B2 Nucleophile-reactive sulfonated compounds for the (radio)labelling of (bio)molecules; precursors and conjugates thereof SULT1E1, TST, SULT1A1 LMNA 3021/4885GAA 2402/4885ALDH1A1 285/4885
US-20110319671-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALIPHATIC FLUOROALCOHOL ADH1A, ADH1C, ADH5 LMNA 3133/4885GAA 531/4885ALDH1A1 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.