SCHEMBL21964022

SCHEMBL21964022

CCCCC(CC)COc1ccc(-c2ccn(C)c2-c2ncnc(-c3c(-c4ccc(OCC(CC)CCCC)cc4O)ccn3C)n2)c(O)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
ALDH1A1 P00352 5/20 0.33
MAPK1 P28482 2/20 0.33
TSHR P16473 1/20 0.33
CYP3A4 P08684 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CA2 P00918 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CNR2 P34972 2/20 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
SCHEMBL579788 0.85 LMNA (0.40) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL29365165 0.85 LMNA (0.40) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL1704092 0.83 LMNA (0.35) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL7217044 0.82 LMNA (0.42) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL268986 0.79 LMNA (0.36) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL18979221 0.79 LMNA (0.40) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL28638598 0.79 LMNA (0.40) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL27481297 0.79 LMNA (0.40) LMNAALDH1A1MAPK1TSHRCYP3A4
SCHEMBL473811 0.78 LMNA (0.41) LMNAALDH1A1MAPK1TSHRMEN1
SCHEMBL30111341 0.78 LMNA (0.41) LMNAALDH1A1MAPK1TSHRMEN1

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-20220000762-A1 COMPOSITIONS FOR TREATING OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES AND SKIN AGEING AND DIAGNOSIS OF OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES S-biomedic N.v. (BE) 2022-01-06 US disclosed
EP-3880304-A1 COMPOSITIONS FOR TREATING OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES AND SKIN AGEING AND DIAGNOSIS OF OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES S-Biomedic NV (BE) 2021-09-22 EP disclosed
CN-113038959-A Composition for treating oxidative stress-related skin diseases and skin aging and diagnosis of oxidative stress-related skin diseases S-生物医药有限公司 2021-06-25 CN disclosed
WO-2020099663-A1 COMPOSITIONS FOR TREATING OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES AND SKIN AGEING AND DIAGNOSIS OF OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES S-biomedic N.v. (BE) 2020-05-22 WO 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-20220000762-A1 COMPOSITIONS FOR TREATING OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES AND SKIN AGEING AND DIAGNOSIS OF OXIDATIVE STRESS-ASSOCIATED SKIN DISEASES CUTA, LPO, PPOX LMNA 2240/4885ALDH1A1 1640/4885MAPK1 3298/4885

“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.