SCHEMBL4241108

SCHEMBL4241108

CC(C)=CCCC(C)=CCO[Si](O)(O)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.56
ALDH1A1 P00352 2/20 0.56
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.52
CYP3A4 P08684 2/20 0.52
MAPT P10636 2/20 0.50
UGT1A1 P22309 1/20 0.50
FNTA P49354 5/20 0.49
FNTB P49356 3/20 0.49
SQLE Q14534 3/20 0.48
TRPV1 Q8NER1 1/20 0.46
PGGT1B P53609 2/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL11304942 1.00 ALOX15 (0.56) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL11304941 0.88 KMT2A (0.60) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL3751818 0.84 ALOX15 (0.56) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL3193242 0.84 ALOX15 (0.56) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL3193249 0.84 ALOX15 (0.56) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL12997108 0.84 ALOX15 (0.56) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL3751814 0.84 ALOX15 (0.56) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL11305912 0.81 ALOX15 (0.53) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL27993750 0.79 KMT2A (0.55) ALOX15ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL10385940 0.79 KMT2A (0.65) ALOX15ALDH1A1KMT2AMEN1CYP3A4

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
US-4254291-A FORMING METAL ESTERS OR ALCOHOLATES, ISOMERIZATION AND HYDROLYSIS USING A TRANSITION METAL COMPOUND CATALYST SCM CORPORATION (US) 1981-03-03 US claimed
US-9587206-B2 Combination of an amino alcohol, a fragrance and a silicic acid ester, and the use of same as a pro-fragrance HENKEL AG & CO. KGAA (DE) 2017-03-07 US disclosed
US-20140323375-A1 COMBINATION OF AN AMINO ALCOHOL, A FRAGRANCE AND A SILICIC ACID ESTER, AND THE USE OF SAME AS A PRO-FRAGRANCE HENKEL AG & CO. KGAA (DE) 2014-10-30 US disclosed
US-20090099382-A1 ACTIVE INGREDIENT CARRIERS WHICH ARE BASED ON SILICON AND CONTAIN AMINOALKYL GROUPS HENKEL AG & CO. KGAA (DE) 2009-04-16 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-20090099382-A1 ACTIVE INGREDIENT CARRIERS WHICH ARE BASED ON SILICON AND CONTAIN AMINOALKYL GROUPS SMYD2, SCLY, SMYD3 ALOX15 795/4885ALDH1A1 114/4885KMT2A 3257/4885

“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.