SCHEMBL4097564

SCHEMBL4097564

FC1(F)C=Cc2ccccc2C1(F)F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
OXTR P30559 1/20 0.30
KDM4E B2RXH2 1/20 0.30
PKM P14618 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
SCHEMBL31568708 0.73 OXTR (0.33) GAAMAPTOXTRKDM4EPKM
SCHEMBL18243851 0.73 OXTR (0.33) GAAMAPTOXTRKDM4EPKM
SCHEMBL2857845 0.71 HTR2C (0.34) PDK2
SCHEMBL6310235 0.71 PDK2 (0.35) PDK2
SCHEMBL29842453 0.70 GAA (0.36) GAAMAPTOXTRKDM4EPKM
SCHEMBL2287265 0.70 GAA (0.36) GAAMAPTOXTRKDM4EPKM
SCHEMBL6049920 0.70 HTR2C (0.36) PDK2
SCHEMBL29390519 0.68 MAPT (0.36) PDK2GAAMAPTOXTRKDM4E
SCHEMBL22584880 0.67 GAA (0.33) GAAMAPTOXTRKDM4EPKM
SCHEMBL18573347 0.67 GAA (0.33) GAAMAPTOXTRKDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1225162-B1 Synthesis of vicinal difluoro aromatics and intermediates thereof AIR PROD & CHEM (US) 2005-03-16 EP claimed
US-20030100806-A1 Synthesis of vicinal difluoro aromatics and intermediates thereof LAL GAURI SANKAR (US) 2003-05-29 US claimed
US-20020198417-A1 SYNTHESIS OF VICINAL DIFLUORO AROMATICS AND INTERMEDIATES THEREOF VERSUM MATERIALS US, LLC 2002-12-26 US claimed
US-6455744-B1 MIXING SOLUTION OF A TETRAFLUORO DERIVATIVE OF AN AROMATIC COMPOUND IN AN ORGANIC SOLVENT WITH REDUCING AGENT IN AQUEOUS AMMONIA, UNDER AN INERT GAS, TO FORM AN AROMATIC COMPOUND CONTAINING TWO VICINAL FLUORINE ATOMS AIR PRODUCTS AND CHEMICALS, INC. 2002-09-24 US claimed
US-20020099247-A1 SYNTHESIS OF VICINAL DIFLUORO AROMATICS AND INTERMEDIATES THEREOF AIR PRODUCTS AND CHEMICALS, INC. 2002-07-25 US claimed
EP-1225162-A1 Synthesis of vicinal difluoro aromatics and intermediates thereof AIR PRODUCTS AND CHEMICALS, INC. (US) 2002-07-24 EP claimed
CN-101903364-A Thiazoline urea and amide derivatives and methods of use thereof ABBOTT LAB 2010-12-01 CN disclosed
US-20090221645-A1 Dihydroimidazothiazole Derivatives PROSIDION LIMITED (GB) 2009-09-03 US disclosed
US-20090221645-A1 Dihydroimidazothiazole Derivatives PROSIDION LIMITED (GB) 2009-09-03 US disclosed
US-20090221645-A1 Dihydroimidazothiazole Derivatives PROSIDION LIMITED (GB) 2009-09-03 US disclosed
CN-101155817-A Dihydroimidazothiazole derivatives PROSIDION LTD (GB) 2008-04-02 CN disclosed
EP-1851232-A2 DIHYDROIMIDAZOTHIAZOLE DERIVATIVES Prosidion Limited (GB) 2007-11-07 EP disclosed
WO-2006085118-A2 DIHYDROIMIDAZOTHIAZOLE DERIVATIVES PROSIDION LIMITED (GB) 2006-08-17 WO disclosed
US-20030149315-A1 Synthesis of vicinal difluoro aromatics and intermediates thereof VERSUM MATERIALS US, LLC 2003-08-07 US disclosed
US-20030100806-A1 Synthesis of vicinal difluoro aromatics and intermediates thereof LAL GAURI SANKAR (US) 2003-05-29 US disclosed
US-6515191-B2 Synthesis of vicinal difluoro aromatics and intermediates thereof AIR PRODUCTS AND CHEMICALS, INC. 2003-02-04 US disclosed
US-20020198417-A1 SYNTHESIS OF VICINAL DIFLUORO AROMATICS AND INTERMEDIATES THEREOF VERSUM MATERIALS US, LLC 2002-12-26 US disclosed
US-6455744-B1 MIXING SOLUTION OF A TETRAFLUORO DERIVATIVE OF AN AROMATIC COMPOUND IN AN ORGANIC SOLVENT WITH REDUCING AGENT IN AQUEOUS AMMONIA, UNDER AN INERT GAS, TO FORM AN AROMATIC COMPOUND CONTAINING TWO VICINAL FLUORINE ATOMS AIR PRODUCTS AND CHEMICALS, INC. 2002-09-24 US disclosed
US-20020099247-A1 SYNTHESIS OF VICINAL DIFLUORO AROMATICS AND INTERMEDIATES THEREOF AIR PRODUCTS AND CHEMICALS, INC. 2002-07-25 US disclosed
EP-1225162-A1 Synthesis of vicinal difluoro aromatics and intermediates thereof AIR PRODUCTS AND CHEMICALS, INC. (US) 2002-07-24 EP 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 (5 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-20030149315-A1 Synthesis of vicinal difluoro aromatics and intermediates thereof HAAO, PAH, PFAS PDK2 2071/4885GAA 1741/4885MAPT 3771/4885
US-20030100806-A1 Synthesis of vicinal difluoro aromatics and intermediates thereof PAH, AHR, HAAO PDK2 1554/4885GAA 2023/4885MAPT 2625/4885
US-20090221645-A1 Dihydroimidazothiazole Derivatives TPH1, HTR3B, HTR1A PDK2 1256/4885GAA 1098/4885MAPT 891/4885
US-20020099247-A1 SYNTHESIS OF VICINAL DIFLUORO AROMATICS AND INTERMEDIATES THEREOF PAH, AHR, HAAO PDK2 1554/4885GAA 2023/4885MAPT 2625/4885
US-20020198417-A1 SYNTHESIS OF VICINAL DIFLUORO AROMATICS AND INTERMEDIATES THEREOF PAH, AHR, HAAO PDK2 1554/4885GAA 2023/4885MAPT 2625/4885

“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.