SCHEMBL2325429

SCHEMBL2325429

O=[Sn](OCc1ccccc1)C(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
ALDH1A1 P00352 5/20 0.33
NPSR1 Q6W5P4 1/20 0.33
IDO1 P14902 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CES1 P23141 1/20 0.32
AGXT P21549 1/20 0.32
LMNA P02545 1/20 0.32
CTRB1 P17538 1/20 0.31
PTPN1 P18031 1/20 0.31
MAPK1 P28482 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A3 Q01959 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL2331962 0.71 HCAR2 (0.33)
SCHEMBL2329268 0.71 ALDH1A1 (0.34) TSHRALDH1A1IDO1CA1CA2
SCHEMBL2331798 0.68 TSHR (0.36) TSHRALDH1A1NPSR1IDO1CA1
SCHEMBL2325244 0.68 TSHR (0.36) TSHRALDH1A1NPSR1IDO1CA1
SCHEMBL2325266 0.67 TSHR (0.35) TSHRALDH1A1IDO1CA1CA2
SCHEMBL2328873 0.65 CES2 (0.34) CES1
SCHEMBL2325434 0.65 TSHR (0.36) TSHRALDH1A1IDO1CA1CA2
SCHEMBL2329276 0.65 TSHR (0.36) TSHRALDH1A1IDO1CA1CA2
SCHEMBL2325257 0.64 MMP2 (0.38) TSHRALDH1A1IDO1CA1CA2
SCHEMBL2324953 0.63 TSHR (0.46) TSHRALDH1A1IDO1CA1CA2

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 3272/4885ALDH1A1 970/4885NPSR1 2792/4885

“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.