SCHEMBL9989007

SCHEMBL9989007

CCO[Si](OCC)(OCC)c1cccc(C2OCCO2)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.32
LMNA P02545 1/20 0.31
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
GSK3B P49841 1/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
CCNB3 Q8WWL7 1/20 0.31
DRD3 P35462 1/20 0.30

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
SCHEMBL574271 0.76 TP53 (0.33) ALDH1A1RAB9A
SCHEMBL5346670 0.75 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2HTTRAB9ALMNA
SCHEMBL28961627 0.74 MEN1 (0.33) ALDH1A1SMN1; SMN2HTTRAB9ALMNA
SCHEMBL1664564 0.72 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2
SCHEMBL30022263 0.72 CYP3A4 (0.48) ALDH1A1SMN1; SMN2
SCHEMBL434177 0.72 CYP3A4 (0.48) ALDH1A1SMN1; SMN2
SCHEMBL11941052 0.70 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2HTTRAB9ALMNA
SCHEMBL6561373 0.70 ACHE (0.42) ALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL2329175 0.68 CYP3A4 (0.36) ALDH1A1HTT
SCHEMBL3675040 0.68 GABRG2 (0.43) ALDH1A1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120041122-A Epoxy resin underfill adhesive and preparation method thereof 深圳先进电子材料国际创新研究院 2025-05-27 CN claimed
CN-114716910-A Organic silicon scratch-resistant antifouling coating for synthetic leather and preparation method thereof 浙江鑫钰新材料有限公司 2022-07-08 CN claimed
CN-120041122-A Epoxy resin underfill adhesive and preparation method thereof 深圳先进电子材料国际创新研究院 2025-05-27 CN disclosed
CN-114716910-B Organic silicon scratch-resistant antifouling coating for synthetic leather and preparation method thereof 浙江鑫钰新材料有限公司 2022-12-27 CN disclosed
CN-114716910-A Organic silicon scratch-resistant antifouling coating for synthetic leather and preparation method thereof 浙江鑫钰新材料有限公司 2022-07-08 CN disclosed
US-9024093-B2 Fluorination of organic compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-05-05 US disclosed
US-20110312903-A1 FLUORINATION OF ORGANIC COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2011-12-22 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-20110312903-A1 FLUORINATION OF ORGANIC COMPOUNDS SLCO1B3, SLCO2B1, FLI1 ALDH1A1 554/4885SMN1; SMN2 2331/4885HTT 2090/4885

“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.