SCHEMBL5178243

SCHEMBL5178243

C=CCOC(=O)C(C)=CCC(O)CO

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.33
CYP3A4 P08684 3/20 0.31
USP2 O75604 2/20 0.31
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
RECQL P46063 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL9333754 0.81 KDM4E (0.40) CYP2D6CYP2C19TSHRUSP2LMNA
SCHEMBL28992619 0.81 TDP1 (0.36) CYP2D6CYP2C19TDP1TSHRCYP3A4
SCHEMBL17311783 0.79 TSHR (0.38) CYP2D6CYP2C19TDP1TSHRCYP3A4
SCHEMBL28567442 0.79 USP2 (0.35) CYP2D6CYP2C19TSHRUSP2LMNA
SCHEMBL4564777 0.78 LMNA (0.33) TDP1TSHRCYP3A4USP2MAPT
SCHEMBL9352668 0.78 TGFBR1 (0.35) CYP2D6CYP2C19ALDH1A1
SCHEMBL11117444 0.77 KDM4E (0.37) CYP2D6CYP2C19TSHRLMNA
Phosphoric Acid SCHEMBL2993370 0.76 KDM4E (0.36) CYP2D6CYP2C19SMN1; SMN2LMNA
SCHEMBL29725187 0.76 CYP2D6 (0.37) CYP2D6CYP2C19TDP1TSHRCYP3A4
Methacrylic Acid SCHEMBL5082927 0.76 CYP2D6 (0.34) CYP2D6CYP2C19TSHR

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-20070265460-A1 PROCESS FOR THE PRODUCTION OF (TRIMETHYLSILYLOXY)SILYLALKYLGLYCEROL METHACRYLATES JOHNSON & JOHNSON VISION CARE INC. 2007-11-15 US disclosed
EP-1791848-A1 PROCESS FOR THE PRODUCTION OF (TRIMETHYLSILYLOXY)SILYLALKYLGLYCEROL METHACRYLATES Johnson and Johnson Vision Care, Inc. (US) 2007-06-06 EP disclosed
WO-2006026245-A1 PROCESS FOR THE PRODUCTION OF (TRIMETHYLSILYLOXY)SILYLALKYLGLYCEROL METHACRYLATES JOHNSON & JOHNSON VISION CARE, INC. (US) 2006-03-09 WO disclosed
US-20060047134-A1 Process for the production of (trimethylsilyloxy)silylalkylglycerol methacrylates JOHNSON & JOHNSON VISION CARE INC. 2006-03-02 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 (2 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-20070265460-A1 PROCESS FOR THE PRODUCTION OF (TRIMETHYLSILYLOXY)SILYLALKYLGLYCEROL METHACRYLATES SGMS2, SGMS1, SMS CYP2D6 2311/4885CYP2C19 1381/4885TDP1 4007/4885
US-20060047134-A1 Process for the production of (trimethylsilyloxy)silylalkylglycerol methacrylates SGMS2, SGMS1, SMS CYP2D6 2311/4885CYP2C19 1381/4885TDP1 4007/4885

“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.