SCHEMBL552501

SCHEMBL552501

C=CC(=C)[Si](CC)(CC)CC

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL610736 0.69
SCHEMBL609632 0.67
SCHEMBL608706 0.65 ALDH1A1 (0.30) ALDH1A1TSHRTP53
SCHEMBL551203 0.65 ALDH1A1 (0.30) ALDH1A1TSHRTP53
SCHEMBL3230735 0.65 HSD17B10 (0.32)
SCHEMBL31707460 0.65 ALDH1A1 (0.41) ALDH1A1TSHRTP53
SCHEMBL3056449 0.65
SCHEMBL610686 0.64
SCHEMBL15302082 0.63
SCHEMBL27935973 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110695-B2 Compounds and compositions containing silicon and/or other heteroatoms and/or metals and methods of making and using them WELKER MARK E (US) 2012-02-07 US disclosed
US-20100056801-A1 Compounds And Compositions Containing Silicon And/Or Other Heteroatoms And/Or Metals And Methods of Making And Using Them WELKER MARK E 2010-03-04 US disclosed
WO-2008054718-A2 COMPOUNDS AND COMPOSITIONS CONTAINING SILICON AND/OR OTHER HETEROATOMS AND/OR METALS AND METHODS OF MAKING AND USING THEM WAKE FOREST UNIVERSITY (US) 2008-05-08 WO disclosed
US-6696518-B1 USING RUTHENIUM AND/OR RHODIUM CATALYST THAT COMPLEXES WITH NONIONIC PHOSPHORUS COMPOUND IN AQUEOUS DISPERSION WITH ADDITION OF ORGANIC SOLVENT; SUPPRESSING CROSSLINKING BASF AKTIENGESELLSCHAFT (DE) 2004-02-24 US disclosed
CN-1120851-C Method for selective hydrogenation of ethylene unsatuated double bouds in polymerizates BASF AG (DE) 2003-09-10 CN disclosed
US-6566457-B2 Graft polymers BASF AKTIENGESELLSCHAFT (DE) 2003-05-20 US disclosed
EP-1189948-B1 METHOD OF SELECTIVELY HYDROGENATING ETHYLENICALLY UNSATURATED DOUBLE BONDS IN POLYMERS BASF AG (DE) 2003-02-26 EP disclosed
EP-1036098-B1 METHOD FOR SELECTIVE HYDROGENATION OF ETHYLENE UNSATURATED DOUBLE BONDS IN POLYMERIZATES BASF AG (DE) 2002-07-24 EP disclosed
US-6403727-B1 REACTING POLYMERS WITH HYDROGEN IN PRESENCE OF HYDROGENATION CATALYST SELECTED FROM RUTHENIUM SALTS AND COMPLEX COMPOUNDS, IN AQUEOUS DISPERSION COMPRISING NOT MORE THAN 20% BY VOLUME OF ORGANIC SOLVENT AT ELEVATED TEMPERATURE AND PRESSURE BASF AKTIENGESELLSCHAFT (DE) 2002-06-11 US disclosed
EP-1189948-A1 METHOD OF SELECTIVELY HYDROGENATING ETHYLENICALLY UNSATURATED DOUBLE BONDS IN POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2002-03-27 EP disclosed
US-20020004565-A1 Novel impact modifiers prepared from (partially) hydrogenated butadiene-containing dispersions BASF AKTIENGESELLSCHAFT (DE) 2002-01-10 US disclosed
EP-1148073-A1 Impact strength modifier based on dispersions containing hydrogenated or partially hydrogenated butadiene BASF AKTIENGESELLSCHAFT (DE) 2001-10-24 EP disclosed
CN-1280587-A Process for selective hydrogenation of ethylenically unsaturated double bonds in polymers BASF AG (DE) 2001-01-17 CN disclosed
WO-2000073357-A1 METHOD OF SELECTIVELY HYDROGENATING ETHYLENICALLY UNSATURATED DOUBLE BONDS IN POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2000-12-07 WO disclosed
EP-0176085-B1 4-SUBSTITUTED-1,2,3,6-TETRAHYDROPHTHALIC ACID ANHYDRIDE AND PRODUCTION PROCESS THEREOF NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1993-04-14 EP disclosed
EP-0154867-B1 2-SUBSTITUTED-1,3-BUTADIENE DERIVATIVES AND PROCESS FOR PRODUCING SAME NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-05-02 EP disclosed
US-4837339-A 4-Substituted-1,2,3,6-tetrahydrophthalic acid anhydride NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1989-06-06 US disclosed
US-4677216-A 2-Substituted-1,3-butadiene derivatives and process for producing same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1987-06-30 US disclosed
EP-0176085-A2 4-Substituted-1,2,3,6-tetrahydrophthalic acid anhydride and production process thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-04-02 EP disclosed
EP-0154867-A1 2-Substituted-1,3-butadiene derivatives and process for producing same NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1985-09-18 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-20100056801-A1 Compounds And Compositions Containing Silicon And/Or Other Heteroatoms And/Or Metals And Methods of Making And Using Them CA6, SOD1, CA1 ALDH1A1 2774/4885TSHR 4621/4885TP53 158/4885

“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.