SCHEMBL21572797

SCHEMBL21572797

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.53
▸ GAA P10253 2/20 0.53
▸ ABCC4 O15439 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ PTGS1 P23219 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ ALDH1A1 P00352 5/20 0.50
▸ HPGD P15428 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ KMT2A Q03164 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ MMP12 P39900 2/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ MMP13 P45452 1/20 0.43
▸ MMP14 P50281 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ PTGS2 P35354 1/20 0.42

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
SCHEMBL29259778 0.83 LMNA (0.49) LMNAGAAABCC4TSHRPTGS1
SCHEMBL21572795 0.83 GAA (0.49) LMNAGAAABCC4TSHRPTGS1
SCHEMBL18970304 0.82 ABCC4 (0.55) LMNAGAAABCC4TSHRPTGS1
SCHEMBL18970284 0.82 ABCC4 (0.55) LMNAGAAABCC4TSHRPTGS1
SCHEMBL21572788 0.82 TSHR (0.47) LMNAGAAABCC4TSHRPTGS1
SCHEMBL21572794 0.81 GAA (0.46) LMNAGAAABCC4TSHRPTGS1
SCHEMBL22295411 0.81 LMNA (0.53) LMNAGAAABCC4TSHRPTGS1
SCHEMBL21572803 0.80 GAA (0.45) LMNAGAAABCC4TSHRPTGS1
SCHEMBL21572801 0.80 LMNA (0.45) LMNAGAAABCC4TSHRPTGS1
SCHEMBL21572810 0.80 GAA (0.45) LMNAGAAABCC4TSHRPTGS1

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 2 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-10479753-B2 Sacubitril intermediate and preparation method thereof SUNSHINE LAKE PHARMA CO., LTD (CN) 2019-11-19 — — 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 (2 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-11370739-B2 Sacubitril intermediate and preparation method thereof DPP4, ACE, DPP8 LMNA 1222/4885GAA 63/4885ABCC4 3539/4885
US-10479753-B2 Sacubitril intermediate and preparation method thereof ACE, DPP4, SI LMNA 2313/4885GAA 63/4885ABCC4 3613/4885

“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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