SCHEMBL20583291

SCHEMBL20583291

CC[Si](CC)(CC)OCC(C)c1cc(C)ccc1S(=O)(=O)O

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.32
▸ NR3C1 P04150 2/20 0.32
▸ MEP1B Q16820 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KAT6A Q92794 1/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ ALPL P05186 1/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ RAPGEF4 Q8WZA2 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MEN1 O00255 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.30
▸ ATM Q13315 1/20 0.30
▸ TSHR P16473 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
SCHEMBL29043266 0.83 NR3C1 (0.31) NR3C1MEP1BALDH1A1CYP2C19MAPK1
SCHEMBL30461153 0.83 NR3C1 (0.31) NR3C1MEP1BALDH1A1CYP2C19MAPK1
SCHEMBL9615904 0.80 RORC (0.39) POLBNR3C1MEP1BALDH1A1CYP2C19
SCHEMBL9724989 0.80 RORC (0.39) POLBNR3C1MEP1BALDH1A1CYP2C19
SCHEMBL15988245 0.78 ALDH1A1 (0.40) POLBMEP1BALDH1A1CYP2C19HSD17B10
SCHEMBL10771314 0.77 CA12 (0.42) POLBMEP1BALDH1A1CYP2C19RAPGEF4
SCHEMBL8971717 0.77 CA12 (0.42) POLBMEP1BALDH1A1CYP2C19RAPGEF4
SCHEMBL775799 0.76 MEP1B (0.36) POLBMEP1BALDH1A1CYP2C19KAT6A
SCHEMBL9614144 0.76 MEP1B (0.36) POLBMEP1BALDH1A1CYP2C19HSD17B10
SCHEMBL29231947 0.74 TACR1 (0.39) ALDH1A1KMT2ASMN1; SMN2L3MBTL1ATM

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-11370739-B2 Sacubitril intermediate and preparation method thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2022-06-28 — — US disclosed
EP-3424899-B1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2022-05-11 — — EP disclosed
US-20200079721-A1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF NORTH & SOUTH BROTHER PHARMACY INVESTMENT COMPANY LIMITED (HK) 2020-03-12 — — US disclosed
US-10479753-B2 Sacubitril intermediate and preparation method thereof SUNSHINE LAKE PHARMA CO., LTD (CN) 2019-11-19 — — US disclosed
EP-3424899-A1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2019-01-09 — — EP disclosed
US-20180362439-A1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-12-20 — — 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 (4 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-20200079721-A1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF DPP4, ACE, DPP8 POLB 2366/4885NR3C1 3200/4885MEP1B 656/4885
US-20180362439-A1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF ACE, DPP4, SI POLB 2779/4885NR3C1 3635/4885MEP1B 1043/4885
US-11370739-B2 Sacubitril intermediate and preparation method thereof DPP4, ACE, DPP8 POLB 2366/4885NR3C1 3200/4885MEP1B 656/4885
US-10479753-B2 Sacubitril intermediate and preparation method thereof ACE, DPP4, SI POLB 2779/4885NR3C1 3635/4885MEP1B 1043/4885

“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.

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