SCHEMBL2019599

SCHEMBL2019599

CC(C)(C)Cc1cccc(O)c1CC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
RIPK1 Q13546 2/20 0.39
ESR1 P03372 1/20 0.39
HSPA5 P11021 1/20 0.38
TRPA1 O75762 1/20 0.37
ATM Q13315 1/20 0.37
IDO1 P14902 2/20 0.36
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IAPP P10997 1/20 0.35
CYP2D6 P10635 1/20 0.34
HIF1A Q16665 1/20 0.34
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
AKR1B1 P15121 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
SCHEMBL10026827 0.87 ESR1 (0.44) GABRA1GABRB2ESR1HSPA5TRPA1
SCHEMBL14099107 0.82 BID (0.45) GABRA1GABRB2IAPP
SCHEMBL6354470 0.81 IAPP (0.48) GABRA1GABRB2RIPK1ESR1HSPA5
SCHEMBL674324 0.80 HSPA5 (0.54) RIPK1ESR1HSPA5IDO1TSHR
SCHEMBL28092551 0.78 HSPA5 (0.52) RIPK1ESR1HSPA5IDO1TSHR
SCHEMBL22374130 0.78 ALDH1A1 (0.41) ATMALDH1A1AKR1B1
SCHEMBL347746 0.78 GABRA1 (0.61) GABRA1GABRB2RIPK1ESR1HSPA5
SCHEMBL15107553 0.78 ANO1 (0.41) ESR1TRPA1ATMTSHRALDH1A1
SCHEMBL14682133 0.78 TSHR (0.43) GABRA1GABRB2ESR1TRPA1ATM
SCHEMBL1839326 0.77 GABRA1 (0.36) GABRA1GABRB2HSPA5TRPA1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247589-B2 Organic silicon phosphate and fabrication method thereof GRAND TEK ADVANCE MATERIAL SCIENCE CO., LTD. (TW) 2012-08-21 US claimed
US-20110160475-A1 ORGANIC SILICON PHOSPHATE AND FABRICATION METHOD THEREOF GRAND TEK ADVANCE MATERIAL SCIENCE CO., LTD. (TW) 2011-06-30 US claimed
CN-102146100-B Organic silicon phosphate and preparation method thereof GUANGKE INDUSTRY CO LTD 2014-07-23 CN disclosed
US-8247589-B2 Organic silicon phosphate and fabrication method thereof GRAND TEK ADVANCE MATERIAL SCIENCE CO., LTD. (TW) 2012-08-21 US disclosed
CN-102146100-A Organic silicon phosphate and preparation method thereof GUANGKE INDUSTRY CO LTD 2011-08-10 CN disclosed
US-20110160475-A1 ORGANIC SILICON PHOSPHATE AND FABRICATION METHOD THEREOF GRAND TEK ADVANCE MATERIAL SCIENCE CO., LTD. (TW) 2011-06-30 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-20110160475-A1 ORGANIC SILICON PHOSPHATE AND FABRICATION METHOD THEREOF SOST, PTEN, INPP5A GABRA1 4388/4885GABRB2 4521/4885RIPK1 1070/4885

“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.