SCHEMBL2199087

SCHEMBL2199087

Cl[SiH](O[SiH](Cl)c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ORAI1 Q96D31 1/20 0.33
ORAI2 Q96SN7 1/20 0.33
ORAI3 Q9BRQ5 1/20 0.33
TRPV6 Q9H1D0 1/20 0.33
LTA4H P09960 1/20 0.32
ALDH1A1 P00352 1/20 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
SCHEMBL5430516 0.78 TSHR (0.32) TSHRORAI1ORAI2ORAI3TRPV6
SCHEMBL8405513 0.78 CA4 (0.38) TSHRORAI1ORAI2ORAI3TRPV6
SCHEMBL11415511 0.76 LTA4H (0.39) TSHRLTA4HALDH1A1
SCHEMBL23701035 0.72 NPSR1 (0.35) TSHRLTA4HALDH1A1
SCHEMBL297217 0.71 TSHR (0.39) TSHRORAI1ORAI2ORAI3TRPV6
SCHEMBL203456 0.71
SCHEMBL28882615 0.71
SCHEMBL11293210 0.69 TSHR (0.37) TSHRORAI1ORAI2ORAI3TRPV6
Water SCHEMBL9174447 0.69 TSHR (0.37) TSHRORAI1ORAI2ORAI3TRPV6
SCHEMBL22830125 0.69 TSHR (0.37) TSHRORAI1ORAI2ORAI3TRPV6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1719794-B1 NOVEL POLYMERS AND USES THEREOF MITSUI CHEMICALS INC (JP) 2017-01-04 EP disclosed
US-7977429-B2 Polymers and uses thereof MITSUI CHEMICALS, INC. (JP) 2011-07-12 US disclosed
EP-1428795-B1 SILSESQUIOXANE DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF CHISSO CORP (JP) 2009-07-22 EP disclosed
US-7449539-B2 Silsesquioxane derivative and production process for the same CHISSO CORPORATION (JP) 2008-11-11 US disclosed
US-20070154431-A1 Novel polymers and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-07-05 US disclosed
US-20070032454-A1 Silsesquioxane derivative and production process for the same JNC CORPORATION (JP) 2007-02-08 US disclosed
US-7169873-B2 Silsesquioxane derivatives and process for production thereof CHISSO CORPORATION (JP) 2007-01-30 US disclosed
EP-1719794-A1 NOVEL POLYMERS AND USES THEREOF Mitsui Takeda Chemicals, Inc. (JP) 2006-11-08 EP disclosed
US-20040249103-A1 Silsesquioxane derivatives and process for production thereof JNC CORPORATION (JP) 2004-12-09 US disclosed
EP-1428795-A1 SILSESQUIOXANE DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF CHISSO CORPORATION (JP) 2004-06-16 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 (2 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-20070154431-A1 Novel polymers and uses thereof RAD54L, VCL, TYR TSHR 2262/4885ORAI1 3384/4885ORAI2 3828/4885
US-20070032454-A1 Silsesquioxane derivative and production process for the same KCNQ1, KCNQ2, KCNQ5 TSHR 4266/4885ORAI1 1165/4885ORAI2 1027/4885

“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.