SCHEMBL5948232

SCHEMBL5948232

CC(C)[C@H]1CC[C@H](C(=O)N[C@@H](Cc2ccc(OCc3ccc(C(F)(F)F)cc3)cc2)C(=O)O)CC1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ MME P08473 4/20 0.61
▸ ACE P12821 4/20 0.61
▸ CPA1 P15085 4/20 0.61
▸ ACE2 Q9BYF1 4/20 0.61
▸ PLG P00747 8/20 0.60
▸ PRSS1 P07477 6/20 0.60
▸ PRSS2 P07478 6/20 0.60
▸ PRSS3 P35030 6/20 0.60
▸ GPR34 Q9UPC5 1/20 0.50
▸ YAP1 P46937 2/20 0.49
▸ PLAU P00749 1/20 0.47
▸ ITGA4 P13612 1/20 0.47
▸ PPARG P37231 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ ADAMTS4 O75173 1/20 0.46
▸ MMP13 P45452 1/20 0.46

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
SCHEMBL5948483 1.00 LMNA (0.62) LMNATDP1MMEACECPA1
SCHEMBL5948486 1.00 LMNA (0.62) LMNATDP1MMEACECPA1
SCHEMBL5948228 1.00 LMNA (0.62) LMNATDP1MMEACECPA1
SCHEMBL6142818 0.91 LMNA (0.66) LMNATDP1MMEACECPA1
SCHEMBL6142855 0.91 LMNA (0.66) LMNATDP1MMEACECPA1
SCHEMBL5948662 0.89 LMNA (0.79) LMNATDP1MMEACECPA1
SCHEMBL5948667 0.89 LMNA (0.79) LMNATDP1MMEACECPA1
SCHEMBL5948570 0.89 LMNA (0.79) LMNATDP1MMEACECPA1
SCHEMBL5948568 0.89 LMNA (0.79) LMNATDP1MMEACECPA1
SCHEMBL5948402 0.84 LMNA (0.73) LMNATDP1

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 4010/4885MME 1706/4885

“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.

Send feedback