SCHEMBL5331935

SCHEMBL5331935

C[Si](C)(C)CCOP(=O)(O)OCC[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 1/20 0.36
PPARD Q03181 1/20 0.33
LPAR3 Q9UBY5 3/20 0.32
LPAR1 Q92633 2/20 0.32
LPAR2 Q9HBW0 2/20 0.32
MVD P53602 1/20 0.32
TSHR P16473 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
SCHEMBL2486177 0.86 FABP3 (0.39) TSHR
SCHEMBL19586648 0.85 LPAR3 (0.46) PPARDLPAR3LPAR1LPAR2
SCHEMBL12677767 0.76 LPAR3 (0.35) BTN3A1LPAR3LPAR1LPAR2
SCHEMBL29442237 0.75 LPAR3 (0.46) LPAR3LPAR1LPAR2
SCHEMBL3342055 0.75 TP53 (0.46)
SCHEMBL31033283 0.73 CYP3A4 (0.36) TSHR
SCHEMBL31033309 0.71 ALDH1A1 (0.37) TSHR
SCHEMBL16681909 0.71 LPAR3 (0.54) LPAR3LPAR1LPAR2
SCHEMBL497177 0.70 LPAR3 (0.46) BTN3A1PPARDLPAR3LPAR1LPAR2
SCHEMBL497295 0.70 BTN3A1 (0.40) BTN3A1PPARDLPAR3LPAR1LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240166673-A1 CRYSTALS AEROMICS, INC. (US) 2024-05-23 US disclosed
US-11725018-B2 Crystals AEROMICS, INC. (US) 2023-08-15 US disclosed
US-20220204536-A1 CRYSTALS AEROMICS, INC. (US) 2022-06-30 US disclosed
US-11117909-B2 Crystals AEROMICS, INC. (US) 2021-09-14 US disclosed
CN-113272302-A Antibiotic compounds, process for their manufacture, pharmaceutical compositions containing them and their use 德彪药业国际股份公司 2021-08-17 CN disclosed
US-20190185496-A1 CRYSTALS AEROMICS, INC. (US) 2019-06-20 US disclosed
EP-3454846-A1 CRYSTALS Aeromics, Inc. (US) 2019-03-20 EP disclosed
CN-109475516-A Crystal 埃罗米克斯公司 2019-03-15 CN disclosed
WO-2017197371-A1 CRYSTALS AEROMICS, INC. (US) 2017-11-16 WO disclosed
US-7235666-B2 Sulfonation of 3-(hydroxymethyl)-5,5-diphenylimidazolidine-2,4-dione followed by phosphating in the presence of trisubstituted aliphatic amine base and a polar aprotic solvent; anticonvulsants, antiepileptic and antiarrhythmia agent CILAG LTD. (CH) 2007-06-26 US disclosed
US-20050272706-A1 Process for the preparation of sodium fosphenytoin CILAG, LTD. 2005-12-08 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 (6 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-20050272706-A1 Process for the preparation of sodium fosphenytoin FOS, DUSP5, DCPS BTN3A1 4160/4885PPARD 2306/4885LPAR3 3350/4885
US-20220204536-A1 CRYSTALS MTAP, PLCG2, PLCG1 BTN3A1 3781/4885PPARD 2747/4885LPAR3 2119/4885
US-20190185496-A1 CRYSTALS MTAP, PLCG2, PLCG1 BTN3A1 3781/4885PPARD 2747/4885LPAR3 2119/4885
US-11725018-B2 Crystals MTAP, PLCG2, PLCG1 BTN3A1 3781/4885PPARD 2747/4885LPAR3 2119/4885
US-20240166673-A1 CRYSTALS MTAP, PLCG2, PLCG1 BTN3A1 3781/4885PPARD 2747/4885LPAR3 2119/4885
US-11117909-B2 Crystals MTAP, PLCG2, PLCG1 BTN3A1 3781/4885PPARD 2747/4885LPAR3 2119/4885

“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.