SCHEMBL4514772

SCHEMBL4514772

C[Si](O)(O)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
TP53 P04637 1/20 0.43
NR1H2 P55055 2/20 0.43
NR1H3 Q13133 2/20 0.43
CALM1 P0DP23 1/20 0.41
ESR1 P03372 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 3/20 0.39
IDO1 P14902 2/20 0.39
THRB P10828 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
AKR1B1 P15121 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.38
TRPA1 O75762 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL679387 0.84 TSHR (0.43) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL28136682 0.84 TSHR (0.43) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL3503476 0.80 TP53 (0.46) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL8577993 0.78 TP53 (0.44) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL1107767 0.78 TP53 (0.48) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL9622630 0.78 TSHR (0.48) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL16378246 0.78 TP53 (0.48) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL231005 0.78 ESR1 (0.56) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL4526742 0.78 TSHR (0.48) TSHRTP53NR1H2NR1H3CALM1
SCHEMBL379345 0.78 TSHR (0.48) TSHRTP53NR1H2NR1H3CALM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9994711-B2 Condensation-curable silicone composition and a semiconductor device SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-06-12 US disclosed
US-9862803-B2 Branched organopolysiloxane and a method for preparing the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-01-09 US disclosed
US-9587075-B2 Addition-curable silicone composition and a semiconductor device SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-03-07 US disclosed
US-20160304675-A1 BRANCHED ORGANOPOLYSILOXANE AND A METHOD FOR PREPARING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-10-20 US disclosed
US-20160304673-A1 ADDITION-CURABLE SILICONE COMPOSITION AND A SEMICONDUCTOR DEVICE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-10-20 US disclosed
US-20160280959-A1 CONDENSATION-CURABLE SILICONE COMPOSITION AND A SEMICONDUCTOR DEVICE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-09-29 US disclosed
US-8791221-B2 Addition-curable metallosiloxane compound DAICEL CORPORATION (JP) 2014-07-29 US disclosed
EP-2650319-A1 ADDITION-CURABLE METALLOSILOXANE COMPOUND Daicel Corporation (JP) 2013-10-16 EP disclosed
US-20130267653-A1 ADDITION-CURABLE METALLOSILOXANE COMPOUND DAICEL CORPORATION (JP) 2013-10-10 US disclosed
CN-103249762-A Addition-curable metallosiloxane compound DAICEL CORP 2013-08-14 CN disclosed
US-7507480-B2 Corrosion-resistant metal surfaces BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) 2009-03-24 US disclosed
US-20060269760-A1 Corrosion-resistant metal surfaces ENERGY, UNITED STATES DEPARTMENT OF 2006-11-30 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-20130267653-A1 ADDITION-CURABLE METALLOSILOXANE COMPOUND B2M, MSI2, MNS1 TSHR 4702/4885TP53 3501/4885NR1H2 4265/4885

“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.