SCHEMBL5948667

SCHEMBL5948667

CC(C)[C@H]1CC[C@H](C(=O)N[C@@H](Cc2ccc(OCc3ccccc3)cc2)C(=O)O)CC1

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.79
▸ TDP1 Q9NUW8 1/20 0.79
▸ PLG P00747 3/20 0.59
▸ PRSS1 P07477 3/20 0.59
▸ PRSS2 P07478 3/20 0.59
▸ PRSS3 P35030 3/20 0.59
▸ PPARG P37231 2/20 0.58
▸ MME P08473 1/20 0.58
▸ ACE P12821 1/20 0.58
▸ CPA1 P15085 1/20 0.58
▸ ACE2 Q9BYF1 1/20 0.58
▸ YAP1 P46937 2/20 0.54
▸ GPR34 Q9UPC5 4/20 0.54
▸ ITGA4 P13612 1/20 0.52
▸ ATM Q13315 1/20 0.50
▸ KMT2A Q03164 1/20 0.50

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
SCHEMBL5948662 1.00 LMNA (0.79) LMNATDP1PLGPRSS1PRSS2
SCHEMBL5948568 1.00 LMNA (0.79) LMNATDP1PLGPRSS1PRSS2
SCHEMBL5948570 1.00 LMNA (0.79) LMNATDP1PLGPRSS1PRSS2
SCHEMBL5948486 0.89 LMNA (0.62) LMNATDP1PLGPRSS1PRSS2
SCHEMBL5948228 0.89 LMNA (0.62) LMNATDP1PLGPRSS1PRSS2
SCHEMBL5948483 0.89 LMNA (0.62) LMNATDP1PLGPRSS1PRSS2
SCHEMBL5948232 0.89 LMNA (0.62) LMNATDP1PLGPRSS1PRSS2
Nateglinide SCHEMBL1692510 0.89 LMNA (1.00) LMNATDP1PLGATMKMT2A
Nateglinide SCHEMBL22088 0.89 LMNA (1.00) LMNATDP1PLGATMKMT2A
Nateglinide SCHEMBL14199702 0.89 LMNA (1.00) LMNATDP1PLGATMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060154970-A1 Alanines compounds, method of preparing them and their use YANG YUSHE 2006-07-13 — — US claimed
EP-1591440-A1 ALANINES COMPOUNDS, METHOD OF PREPARING THEM AND THEIR USE SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2005-11-02 — — EP claimed
US-20060154970-A1 Alanines compounds, method of preparing them and their use YANG YUSHE 2006-07-13 — — US disclosed
EP-1591440-A1 ALANINES COMPOUNDS, METHOD OF PREPARING THEM AND THEIR USE SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2005-11-02 — — EP 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-20060154970-A1 Alanines compounds, method of preparing them and their use IAPP, ASNS, GLS2 LMNA 781/4885TDP1 4010/4885PLG 3195/4885

“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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