SCHEMBL1421241

SCHEMBL1421241

C=CCCCCOC(=O)C(C)(C)Br

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
LPAR3 Q9UBY5 2/20 0.41
LMNA P02545 2/20 0.41
LPAR2 Q9HBW0 1/20 0.41
CYP3A4 P08684 3/20 0.38
TSHR P16473 3/20 0.38
MAPT P10636 3/20 0.37
ABCC4 O15439 1/20 0.37
USP2 O75604 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RECQL P46063 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 2/20 0.36
PRKCA P17252 1/20 0.34
ATM Q13315 1/20 0.33
FAAH O00519 1/20 0.33

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
SCHEMBL350859 0.98 ALDH1A1 (0.43) ALDH1A1LPAR3LMNALPAR2CYP3A4
SCHEMBL5023074 0.95 ALDH1A1 (0.40) ALDH1A1LPAR3LMNALPAR2CYP3A4
SCHEMBL17026180 0.91 ALDH1A1 (0.38) ALDH1A1LPAR3LMNALPAR2CYP3A4
SCHEMBL27721943 0.89 ALDH1A1 (0.37) ALDH1A1LPAR3LMNALPAR2CYP3A4
SCHEMBL3479432 0.87 POLB (0.34) ALDH1A1LMNATSHRL3MBTL1HPGD
SCHEMBL12284310 0.85 ALDH1A1 (0.35) ALDH1A1LMNACYP3A4TSHRMAPT
SCHEMBL21986683 0.85 LPAR3 (0.43) ALDH1A1LPAR3LMNALPAR2CYP3A4
SCHEMBL37083 0.84 POLB (0.39) ALDH1A1LMNACYP3A4TSHRFAAH
SCHEMBL10608173 0.84 PRKCA (0.46) ALDH1A1LPAR3LMNALPAR2CYP3A4
SCHEMBL18319741 0.84 PRKCA (0.46) ALDH1A1LPAR3LMNALPAR2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434794-B2 Silicon compound and method for producing same, and use thereof TOYO TIRE & RUBBER CO., LTD. (JP) 2016-09-06 US disclosed
US-9434794-B2 Silicon compound and method for producing same, and use thereof TOYO TIRE & RUBBER CO., LTD. (JP) 2016-09-06 US disclosed
US-9434794-B2 Silicon compound and method for producing same, and use thereof TOYO TIRE & RUBBER CO., LTD. (JP) 2016-09-06 US disclosed
US-20150038643-A1 SILICON COMPOUND AND METHOD FOR PRODUCING SAME, AND USE THEREOF TOYO TIRE & RUBBER CO., LTD. (JP) 2015-02-05 US disclosed
US-20150038643-A1 SILICON COMPOUND AND METHOD FOR PRODUCING SAME, AND USE THEREOF TOYO TIRE & RUBBER CO., LTD. (JP) 2015-02-05 US disclosed
US-20150038643-A1 SILICON COMPOUND AND METHOD FOR PRODUCING SAME, AND USE THEREOF TOYO TIRE & RUBBER CO., LTD. (JP) 2015-02-05 US disclosed
EP-2297222-B1 POLYMERIZABLE COMPOSITION CONTAINING INORGANIC PARTICLES HAVING AN ORGANIC SHELL HENKEL AG & CO KGAA (DE) 2011-11-02 EP disclosed
EP-2297222-A1 POLYMERIZABLE COMPOSITION CONTAINING INORGANIC PARTICLES HAVING AN ORGANIC SHELL Henkel AG & Co. KGaA (DE) 2011-03-23 EP disclosed
WO-2010003940-A1 POLYMERIZABLE COMPOSITION CONTAINING INORGANIC PARTICLES HAVING AN ORGANIC SHELL HENKEL AG & CO. KGAA (DE) 2010-01-14 WO 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-20150038643-A1 SILICON COMPOUND AND METHOD FOR PRODUCING SAME, AND USE THEREOF SPIN1, SRM, SMS ALDH1A1 633/4885LPAR3 3171/4885LMNA 4105/4885

“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.