SCHEMBL6156817

SCHEMBL6156817

CC(C)(C)[Si](OCC(O)CCl)(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.41
SMYD2 Q9NRG4 2/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 2/20 0.34
CYP3A4 P08684 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ADRB2 P07550 3/20 0.33
ADRB1 P08588 2/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.33
GAA P10253 1/20 0.33
ADRB3 P13945 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TRPA1 O75762 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
SCHEMBL24312400 0.90 CYP2D6 (0.38) SMYD2CYP2D6MAPTCYP3A4HTT
SCHEMBL7155286 0.89 CYP2D6 (0.37) SMYD2CYP2D6MAPTCYP3A4HTT
SCHEMBL21873649 0.87 CYP1A2 (0.42) ARCYP2D6CYP3A4HTTSMN1; SMN2
SCHEMBL2531862 0.87 CYP1A2 (0.42) ARCYP2D6CYP3A4HTTSMN1; SMN2
SCHEMBL218117 0.87 CYP1A2 (0.42) ARCYP2D6CYP3A4HTTSMN1; SMN2
SCHEMBL6158503 0.86 CYP3A4 (0.37) SMYD2CYP2D6MAPTCYP3A4HTT
SCHEMBL26106456 0.85 SMYD2 (0.40) ARSMYD2CYP2D6MAPTCYP3A4
SCHEMBL26106462 0.85 SMYD2 (0.40) ARSMYD2CYP2D6MAPTCYP3A4
SCHEMBL15209482 0.84 ALOX15 (0.44) CYP2D6CYP3A4HTTSMN1; SMN2KMT2A
SCHEMBL31200933 0.84 MAPT (0.44) SMYD2CYP2D6MAPTCYP3A4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1505156-B1 Process for the enantioselective preparation of secondary alcohols by lipase catalysed solvolysis of the corresponding acetoacetic acid ester CONSORTIUM ELEKTROCHEM IND (DE) 2005-12-07 EP disclosed
US-20050032182-A1 Process for the enantioselective preparation of secondary alcohols by lipase-catalyzed solvolysis of the corresponding acetoacetic esters CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH 2005-02-10 US disclosed
EP-1505156-A1 Process for the enantioselective preparation of secondary alcohols by lipase catalysed solvolysis of the corresponding acetoacetic acid ester Consortium für elektrochemische Industrie GmbH (DE) 2005-02-09 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-20050032182-A1 Process for the enantioselective preparation of secondary alcohols by lipase-catalyzed solvolysis of the corresponding acetoacetic esters LIPC, LIPE, LIPA AR 2062/4885SMYD2 1747/4885CYP2D6 807/4885

“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.