SCHEMBL2325244

SCHEMBL2325244

FC(F)C(F)(F)C(F)(F)C(F)[Sn](OCc1ccccc1)(OCc1ccccc1)C(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
IDO1 P14902 1/20 0.34
AGXT P21549 1/20 0.33
CA1 P00915 4/20 0.33
ALDH1A1 P00352 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PDK2 Q15119 1/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
XBP1 P17861 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
EPHX2 P34913 1/20 0.31
CA2 P00918 3/20 0.30
CA9 Q16790 3/20 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
SCHEMBL2331798 0.87 TSHR (0.36) TSHRIDO1AGXTCA1ALDH1A1
SCHEMBL2328698 0.69 TSHR (0.39) TSHRIDO1AGXTCA1ALDH1A1
SCHEMBL2327784 0.69 TSHR (0.35) TSHRIDO1AGXTCA1ALDH1A1
SCHEMBL2328694 0.69 TSHR (0.35) TSHRIDO1AGXTALDH1A1TP53
SCHEMBL2327062 0.69 GAA (0.30)
SCHEMBL2325429 0.68 TSHR (0.34) TSHRIDO1AGXTCA1ALDH1A1
SCHEMBL2345113 0.67 TSHR (0.33) TSHRIDO1AGXTALDH1A1TP53
SCHEMBL2364087 0.67 TSHR (0.36) TSHRIDO1AGXTCA1ALDH1A1
SCHEMBL2347617 0.65 TSHR (0.57) TSHRIDO1AGXTCA1ALDH1A1
SCHEMBL4544269 0.65 TSHR (0.34) TSHRIDO1AGXTCA1ALDH1A1

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-1987881-B1 METHOD FOR SEPARATION AND COLLECTION OF DIALKYL TIN DIALKOXIDE ASAHI KASEI CHEMICALS CORP (JP) 2011-08-17 EP disclosed
US-7842828-B2 Method for separating out and recovering dialkyltin dialkoxide ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-11-30 US disclosed
US-20100160662-A1 Method for Separating Out and Recovering Dialkyltin Dialkoxide ASAHI KASEI KABUSHIKI KAISHA (JP) 2010-06-24 US disclosed
EP-1987881-A1 METHOD FOR SEPARATION AND COLLECTION OF DIALKYL TIN DIALKOXIDE Asahi Kasei Chemicals Corporation (JP) 2008-11-05 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 (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-20100160662-A1 Method for Separating Out and Recovering Dialkyltin Dialkoxide ALOX5, ALOX15B, ALOX15 TSHR 3272/4885IDO1 2152/4885AGXT 449/4885

“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.