⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21128880 | 0.83 | ALDH1A1 (0.39) | — | |
| SCHEMBL17447694 | 0.83 | ALDH1A1 (0.39) | — | |
| SCHEMBL12268506 | 0.83 | — | — | |
| SCHEMBL12758187 | 0.79 | LMNA (0.35) | — | |
| SCHEMBL21482305 | 0.78 | — | — | |
| SCHEMBL21128879 | 0.78 | NR1H2 (0.32) | — | |
| SCHEMBL12101246 | 0.77 | MAPK1 (0.33) | — | |
| SCHEMBL12758190 | 0.77 | MAPK1 (0.33) | — | |
| SCHEMBL12758191 | 0.69 | KMT2A (0.46) | — | |
| SCHEMBL14615681 | 0.67 | GAA (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120269749-A1 | COSMETIC COMPOSITIONS COMPRISING AN ESTER DERIVED FROM 4-CARBOXY-2-PYRROLIDINONE AND A MEROCYANIN SCREENING AGENT; USE OF SAID DERIVATIVE AS A SOLVENT FOR A MEROCYANIN SCREENING AGENT | L'OREAL (FR) | 2012-10-25 | — | — | US | disclosed |
| US-8025867-B2 | Photoprotective cosmetic compositions comprising photostabilized dibenzoylmethane compounds and merocyanine sulfone compounds | L'OREAL (FR) | 2011-09-27 | — | — | US | disclosed |
| US-7510703-B2 | UV-photoprotecting/sunscreen compositions comprising silane/siloxane derivatives of merocyanine sulfones | L'OREAL (FR) | 2009-03-31 | — | — | US | disclosed |
| US-20080305058-A1 | Photoprotective cosmetic compositions comprising photostabilized dibenzoylmethane compounds and merocyanine sulfone compounds | L'OREAL (FR) | 2008-12-11 | — | — | US | disclosed |
| US-20070224147-A1 | UV-photoprotecting/sunscreen compositions comprising silane/siloxane derivatives of merocyanine sulfones | L'OREAL (FR) | 2007-09-27 | — | — | US | disclosed |