SCHEMBL2331966

SCHEMBL2331966

O=[Sn](OCCc1ccccc1)C(F)(F)C(F)(F)CC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
AKR1B10 O60218 2/20 0.35
AKR1B1 P15121 2/20 0.35
TDP1 Q9NUW8 2/20 0.34
CES1 P23141 4/20 0.33
FAAH O00519 3/20 0.33
HCAR2 Q8TDS4 1/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
FFAR1 O14842 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
IDO1 P14902 1/20 0.33
MAOB P27338 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
GLA P06280 1/20 0.32
CYP3A4 P08684 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
SCHEMBL2325434 0.84 TSHR (0.36) CA1CA2CA9TDP1CES1
SCHEMBL2331956 0.82 CA1 (0.35) CA1CA2CA9AKR1B10AKR1B1
SCHEMBL2321902 0.81 CA1 (0.37) CA1CA2CA9AKR1B10AKR1B1
SCHEMBL2325535 0.78 CA1 (0.37) CA1CA2CA9AKR1B10AKR1B1
SCHEMBL2325168 0.71 MMP2 (0.36) CA1CA2CA9AKR1B10AKR1B1
SCHEMBL2326175 0.70 CA1 (0.34) CA1CA2CA9TDP1CES1
SCHEMBL2321787 0.70 CA1 (0.34) CA1CA2CA9TDP1CES1
SCHEMBL2329240 0.68
SCHEMBL2329042 0.67 CA1 (0.44) CA1CA2CA9AKR1B10AKR1B1
SCHEMBL2325986 0.66 CES2 (0.39) CA1CA2CA9CES1FAAH

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 CA1 874/4885CA2 755/4885CA9 370/4885

“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.