SCHEMBL20583259

SCHEMBL20583259

CC(C)OC(=O)[C@H](C)C[C@H](N)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GPR88 Q9GZN0 1/20 0.49
▸ SRR Q9GZT4 2/20 0.47
▸ PSAT1 Q9Y617 2/20 0.47
▸ PDCD1 Q15116 1/20 0.47
▸ CD274 Q9NZQ7 1/20 0.47
▸ MME P08473 10/20 0.46
▸ ACE P12821 10/20 0.46
▸ MAPT P10636 1/20 0.45
▸ PPARG P37231 1/20 0.43
▸ PPARA Q07869 1/20 0.43

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
SCHEMBL20583257 1.00 GPR88 (0.49) GPR88SRRPSAT1PDCD1CD274
SCHEMBL20583255 1.00 GPR88 (0.49) GPR88SRRPSAT1PDCD1CD274
SCHEMBL20583645 0.88 MME (0.50) GPR88SRRPSAT1MMEACE
SCHEMBL20583644 0.88 MME (0.50) GPR88SRRPSAT1MMEACE
SCHEMBL20583647 0.88 MME (0.50) GPR88SRRPSAT1MMEACE
SCHEMBL8522871 0.88 MME (0.50) GPR88SRRPSAT1MMEACE
SCHEMBL24404055 0.86 GPR88 (0.49) GPR88SRRPSAT1MMEACE
SCHEMBL21572784 0.86 GPR88 (0.49) GPR88SRRPSAT1MMEACE
SCHEMBL598890 0.86 GPR88 (0.49) GPR88SRRPSAT1MMEACE
SCHEMBL597164 0.86 GPR88 (0.49) GPR88SRRPSAT1MMEACE

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-11370739-B2 Sacubitril intermediate and preparation method thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2022-06-28 — — US disclosed
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
EP-3424899-B1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2022-05-11 — — EP disclosed
CN-106977415-B Intermediate of shakubiqu and preparation method thereof 广东东阳光药业有限公司 2021-03-26 — — CN disclosed
CN-107216277-B Preparation method of LCZ696 medicine impurity 东南大学 2020-04-24 — — CN 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
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 GPR88 1950/4885SRR 1242/4885PSAT1 634/4885
US-20180362439-A1 SACUBITRIL INTERMEDIATE AND PREPARATION METHOD THEREOF ACE, DPP4, SI GPR88 2233/4885SRR 1241/4885PSAT1 758/4885
US-11370739-B2 Sacubitril intermediate and preparation method thereof DPP4, ACE, DPP8 GPR88 1950/4885SRR 1242/4885PSAT1 634/4885
US-10479753-B2 Sacubitril intermediate and preparation method thereof ACE, DPP4, SI GPR88 2233/4885SRR 1241/4885PSAT1 758/4885

“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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