SCHEMBL4449502

SCHEMBL4449502

Fc1c(Cl)c(F)c(Cl)c(Cl)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL1756500 0.95 CES2 (0.38) CES2CES1MEN1ALDH1A1LMNA
SCHEMBL4453076 0.91 CES2 (0.33) CES2CES1
SCHEMBL5848856 0.91 CES2 (0.33) CES2CES1
SCHEMBL1756530 0.86 CES2 (0.38) CES2CES1MEN1ALDH1A1LMNA
SCHEMBL10589276 0.82 CES2 (0.36) CES2CES1
SCHEMBL1756525 0.82 CES2 (0.43) CES2CES1MEN1ALDH1A1LMNA
SCHEMBL4345041 0.80 CES2 (0.33) CES2CES1
SCHEMBL219009 0.76 CES2 (0.38) CES2CES1
SCHEMBL7214722 0.76 CES2 (0.38) CES2CES1
SCHEMBL1756501 0.76 CES2 (0.38) CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1912503-A2 FUNGICIDAL MIXTURES CONTAINING SUBSTITUTED 1-METHYL PYRAZOL-4-YL CARBOXYLIC ACID ANILIDES BASF SE (DE) 2008-04-23 EP claimed
EP-1903868-A1 FUNGICIDAL MIXTURES MADE FROM 1-METHYLPYRAZOL-4-YLCARBOXANILIDES BASF SE (DE) 2008-04-02 EP claimed
EP-1901609-A2 FUNGICIDE MIXTURES BASED ON 3-MONOSUBSTITUTED PYRAZOLE CARBOXYLIC ACID BIPHENYL AMIDES BASF SE (DE) 2008-03-26 EP claimed
WO-2007017416-A2 FUNGICIDAL MIXTURES CONTAINING SUBSTITUTED 1-METHYL PYRAZOL-4-YL CARBOXYLIC ACID ANILIDES BASF SE (DE) 2007-02-15 WO claimed
WO-2007003644-A1 FUNGICIDAL MIXTURES MADE FROM 1-METHYLPYRAZOL-4-YLCARBOXANILIDES BASF AKTIENGESELLSCHAFT (DE) 2007-01-11 WO claimed
WO-2007003603-A2 FUNGICIDE MIXTURES BASED ON 3-MONOSUBSTITUTED PYRAZOLE CARBOXYLIC ACID BIPHENYL AMIDES BASF AKTIENGESELLSCHAFT (DE) 2007-01-11 WO claimed
US-7595426-B2 Method for the production of 1,3,5-trifluoro-2,4,6-trichlorobenzene from fluorobenzene derivatives BASF AKTIENGESELLSCHAFT (DE) 2009-09-29 US disclosed
US-20080214878-A1 Method For The Production Of 1,3,5-Trifluoro-2,4,6-Trichlorobenzene From Fluorobenzene Derivatives BASF AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
EP-1909579-A1 FUNGICIDAL MIXTURES BASED ON AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2008-04-16 EP disclosed
EP-1874715-A1 METHOD FOR THE PRODUCTION OF 1,3,5-TRIFLUORO-2,4,6-TRICHLOROBENZENE FROM FLUOROBENZENE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2008-01-09 EP disclosed
EP-1830650-A1 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2007-09-12 EP disclosed
EP-1830653-A1 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2007-09-12 EP disclosed
WO-2007012598-A1 FUNGICIDAL MIXTURES BASED ON AZOLOPYRIMIDINYLAMINES BASF AKTIENGESELLSCHAFT (DE) 2007-02-01 WO disclosed
WO-2005032256-A1 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2005-04-14 WO disclosed
WO-2005032254-A1 FUNGICIDE MIXTURES FOR THE CONTROL OF RICE PATHOGENS BASF AKTIENGESELLSCHAFT (DE) 2005-04-14 WO disclosed
WO-2005032255-A1 FUNGICIDE MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2005-04-14 WO disclosed
US-6198011-B1 FLUORINATING CHLORINE CONTAINING ORGANIC COMPOUND COMPRISING REACTING IN SOLVENT REACTION MEDIUM ORGANIC COMPOUND WITH ALKALI METAL FLUORIDE WHEREIN SOLVENT AT LEAST BEFORE REACTION STARTS COMPRISES PERFLUOROCARBON F2 CHEMICALS LTD. (GB) 2001-03-06 US disclosed
EP-0954515-A1 SOLVENTS FOR USE IN FLUORINATION REACTIONS F2 Chemicals Limited (GB) 1999-11-10 EP disclosed
WO-1998055429-A1 SOLVENTS FOR USE IN FLUORINATION REACTIONS F2 CHEMICALS LTD. (GB) 1998-12-10 WO disclosed
US-5041674-A Chlorinating 1-chloro-3,5-difluorobenzene, nitrating and reducing DOWELANCO (US) 1991-08-20 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 (1 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-20080214878-A1 Method For The Production Of 1,3,5-Trifluoro-2,4,6-Trichlorobenzene From Fluorobenzene Derivatives FLNB, AFF1, AFF2 CES2 52/4885CES1 324/4885MEN1 3209/4885

“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.