SCHEMBL5701840

SCHEMBL5701840

CCCC[Sn](CCCC)(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.41
PSMD14 O00487 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MMP2 P08253 1/20 0.37
MC4R P32245 1/20 0.37
RAD52 P43351 1/20 0.37
HPGD P15428 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
GAA P10253 1/20 0.33
TRPA1 O75762 1/20 0.33
KCNH3 Q9ULD8 1/20 0.33
TSHR P16473 1/20 0.33
ACHE P22303 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL5702219 0.83 HTR7 (0.41) HTR7PSMD14HSP90AA1MMP2MC4R
SCHEMBL1096789 0.83 HTR7 (0.41) HTR7PSMD14HSP90AA1MMP2MC4R
SCHEMBL28882602 0.78 ESR1 (0.45) TSHRACHELMNA
SCHEMBL442385 0.77 SIGMAR1 (0.39) TSHR
SCHEMBL9010525 0.75 FFAR1 (0.41) HTR7PSMD14HSP90AA1MMP2MC4R
SCHEMBL15529600 0.72 PSMD14 (0.40) HTR7PSMD14HSP90AA1MMP2MC4R
Iodide SCHEMBL15529717 0.70 SIGMAR1 (0.41)
SCHEMBL15375331 0.70 SIGMAR1 (0.41)
SCHEMBL1983658 0.69 TSHR (0.32) TSHRLMNA
SCHEMBL1661857 0.68 HTR7 (0.49) HTR7HPGDHDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1211256-B1 Method for purifying fluoroaryl metal compound NIPPON CATALYTIC CHEM IND (JP) 2006-08-02 EP disclosed
US-6509488-B2 Magnesium halide is precipitated and removed from solution containing fluoroaryl metal compound, magnesium halide, and ether solvent, or magnesium halide is removed by treating solution with acid NIPPON SHOKUBAI CO., LTD. (JP) 2003-01-21 US disclosed
EP-1211256-A2 Method for purifying fluoroaryl metal compound Nippon Shokubai Co., Ltd. (JP) 2002-06-05 EP disclosed
US-20020065425-A1 Method for purifying fluoroaryl metal compound NIPPON SHOKUBAI CO., LTD. (JP) 2002-05-30 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-20020065425-A1 Method for purifying fluoroaryl metal compound MLLT3, AFF2, AFF4 HTR7 1538/4885PSMD14 1984/4885HSP90AA1 847/4885

“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.