SCHEMBL850644

SCHEMBL850644

O=C(O)CCCCCCC(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.60
LMNA P02545 3/20 0.60
NFKB1 P19838 1/20 0.60
PMP22 Q01453 1/20 0.60
GPR84 Q9NQS5 8/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 2/20 0.50
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
ALDH1A1 P00352 3/20 0.48
PTPN1 P18031 3/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 2/20 0.48
FABP4 P15090 2/20 0.48
ALOX15 P16050 2/20 0.48
KMT2A Q03164 2/20 0.48
SLC22A6 Q4U2R8 2/20 0.48

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
SCHEMBL31049877 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL8759579 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL31049871 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL10442027 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL7813622 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL10442148 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL5247469 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL19706336 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL5249605 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL21850118 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1131131-A None JP disclosed
US-20250361250-A1 FLUORINE-CONTAINING SILANE COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2025-11-27 US disclosed
CN-115974713-B Fluorine-containing compound, preparation method and compound containing fluorine-containing compound 中国科学技术大学 2024-10-01 CN disclosed
WO-2024172034-A1 FLUORINE-CONTAINING SILANE COMPOUND ダイキン工業株式会社 2024-08-22 WO disclosed
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES INC (US) 2023-07-27 US disclosed
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES INC (US) 2023-07-27 US disclosed
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES INC (US) 2023-07-27 US disclosed
WO-2021252640-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES, INC. (US) 2021-12-16 WO disclosed
WO-2021252640-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES, INC. (US) 2021-12-16 WO disclosed
EP-3257864-A1 METABOLICALLY STABLE SPEXIN PEPTIDE ANALOGS Université de Strasbourg (FR) 2017-12-20 EP disclosed
US-5397563-A Perfluoro-t-butyl-containing steroids for use in fluorine-19 NMR and/or MRI THE JOHNS HOPKINS UNIVERSITY (US) 1995-03-14 US disclosed
US-5324504-A Nine magnetically equivalent fluorine nuclei generate a single intense resonance for detection THE JOHNS HOPKINS UNIVERSITY (US) 1994-06-28 US disclosed
US-5234680-A Generates single, intense resonance for easy detection in imaging or spectroscopy JOHNS HOPKINS UNIV. (US) 1993-08-10 US disclosed
CN-1065454-A Activity optically active carboxylic acid and method for making thereof and medicinal compositions BOEHRINGER MANNHEIM GMBH (DE) 1992-10-21 CN disclosed
US-5116599-A Imaging compounds for medical diagnosis JOHNS HOPKINS UNIV. (US) 1992-05-26 US disclosed
EP-0485479-A1 PERFLUORO-T-BUTYL-CONTAINING COMPOUNDS FOR USE IN FLUORINE-19 NMR AND/OR MRI. UNIV JOHNS HOPKINS (US) 1992-05-20 EP disclosed
EP-0440134-A1 Mesomorphic compound, liquid crystal composition containing same, liquid crystal device using same and display apparatus CANON KABUSHIKI KAISHA (JP) 1991-08-07 EP disclosed
WO-1991001759-A1 PERFLUORO-T-BUTYL-CONTAINING COMPOUNDS FOR USE IN FLUORINE-19 NMR AND/OR MRI THE JOHNS HOPKINS UNIVERSITY (US) 1991-02-21 WO disclosed
EP-0350334-A2 A process for producing fluorine-containing compounds NIKKO KYODO CO., LTD. (JP) 1990-01-10 EP disclosed
JP-H01131131-A OPTICALLY ACTIVE SUBSTANCE, ITS PRODUCTION AND LIQUID CRYSTAL COMPOSITION CONTAINING SAID SUBSTANCE CANON INC 1989-05-24 JP 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 (2 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-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME ASNS, SI, NARS1 TSHR 4589/4885LMNA 2652/4885NFKB1 1320/4885
US-20250361250-A1 FLUORINE-CONTAINING SILANE COMPOUND FLI1, AFF1, RFT1 TSHR 2035/4885LMNA 1768/4885NFKB1 3205/4885

“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.