SCHEMBL2819271

SCHEMBL2819271

CCCCC(CC)COC(=O)c1ccc(N)cc1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.70
ALDH1A1 P00352 7/20 0.65
TSHR P16473 3/20 0.65
MAPK1 P28482 3/20 0.65
CYP3A4 P08684 5/20 0.65
CA2 P00918 2/20 0.65
PRSS1 P07477 1/20 0.59
PRSS2 P07478 1/20 0.59
PRSS3 P35030 1/20 0.59
HSD17B10 Q99714 1/20 0.52
GAA P10253 2/20 0.51
TDP1 Q9NUW8 3/20 0.47
ATM Q13315 1/20 0.47
MAPT P10636 3/20 0.44
TP53 P04637 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
TBXA2R P21731 1/20 0.44
SLC6A2 P23975 1/20 0.44
PDE4A P27815 1/20 0.44

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
SCHEMBL9444077 0.91 LMNA (0.69) LMNAALDH1A1TSHRMAPK1CYP3A4
SCHEMBL7732291 0.91 TSHR (0.74) LMNAALDH1A1TSHRMAPK1CYP3A4
SCHEMBL7521612 0.86 LMNA (0.72) LMNAALDH1A1TSHRMAPK1CYP3A4
SCHEMBL18069229 0.85 LMNA (0.74) LMNAALDH1A1TSHRMAPK1CYP3A4
SCHEMBL9062509 0.84 LMNA (0.69) LMNAALDH1A1TSHRMAPK1CYP3A4
Octisalate SCHEMBL31160278 0.83 LMNA (1.00) LMNAALDH1A1TSHRMAPK1CYP3A4
Octisalate SCHEMBL29362543 0.83 LMNA (1.00) LMNAALDH1A1TSHRMAPK1CYP3A4
Octisalate SCHEMBL31160283 0.83 LMNA (1.00) LMNAALDH1A1TSHRMAPK1CYP3A4
Octisalate SCHEMBL1923015 0.83 LMNA (1.00) LMNAALDH1A1TSHRMAPK1CYP3A4
Octisalate SCHEMBL14764329 0.83 LMNA (1.00) LMNAALDH1A1TSHRMAPK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170135933-A1 PHOTOPROTECTIVE COMPOSITIONS COMPRISING PHOTOSENSITIVE 1,3,5-TRIAZINE COMPOUNDS, DIBENZOYLMETHANE COMPOUNDS AND SILICEOUS S-TRIAZINES SUBSTITUTED WITH TWO AMINOBENZOATE OR AMINOBENZAMIDE GROUPS L'OREAL (FR) 2017-05-18 US disclosed
US-9526924-B2 Composition comprising a screening agent of the lipophilic 2-hydroxybenzophenone type and a silicon-compromising s-triazine substituted by at least two alkylaminobenzoate groups L'OREAL (FR) 2016-12-27 US disclosed
US-8999299-B2 Photoprotective cosmetic compositions comprising silicon-containing s-triazine compounds substituted with two aminobenzoate or aminobenzamide groups and non-silicon-containing lipophilic triazine compound UV-screening agents L'OREAL (FR) 2015-04-07 US disclosed
US-8747816-B2 UV-photoprotective compositions comprising diebenzoylmethane screening agents and silicon-containing s-triazine compounds substituted with two aminobenzoate or aminobenzamide groups L'OREAL (FR) 2014-06-10 US disclosed
CN-101184763-B Photostabilization of dibenzoylmethane by silicon-containing s-triazines substituted with two aminobenzoate or aminobenzamide groups, photoprotective compositions, novel silicon-containing s-triazine compounds OREAL 2013-01-16 CN disclosed
US-20120201767-A1 COMPOSITION COMPRISING A SCREENING AGENT OF THE LIPOPHILIC 2-HYDROXYBENZOPHENONE TYPE AND A SILICON-COMPRISING S-TRIAZINE SUBSTITUTED BY AT LEAST TWO ALKYLAMINOBENZOATE GROUPS L'OREAL (FR) 2012-08-09 US disclosed
CN-102548528-A Composition containing at least one lipophilic 2-hydroxybenzophenone filter and a silicon s-triazine substituted by at least two alkylaminobenzoate groups OREAL 2012-07-04 CN disclosed
EP-1891079-B1 PHOTOSTABILIZATION OF A DIBENZOYLMETHANE BY A SILICON- CONTAINING S-TRIAZINE SUBSTITUTED WITH TWO AMINOBENZOATE OR AMINOBENZAMIDE GROUPS; PHOTOPROTECTIVE COMPOSITIONS. NOVEL SILICON-CONTAINING S-TRIAZINE COMPOUNDS OREAL (FR) 2010-10-27 EP disclosed
US-20100003207-A1 Photoprotective compositions comprising photosensitive 1,3,5-triazine compounds, dibenzoylmethane compounds and siliceous s-triazines substituted with two aminobenzoate or aminobenzamide groups L'OREAL (FR) 2010-01-07 US disclosed
US-20080145324-A1 UV-photoprotective compositions comprising diebenzoylmethane screening agents and silicon-containing s-triazine compounds substituted with two aminobenzoate or aminobenzamide groups L'OREAL (FR) 2008-06-19 US disclosed
US-20080138303-A1 Photoprotective cosmetic compositions comprising silicon-containing s-triazine compounds substituted with two aminobenzoate or aminobenzamide groups and non-silicon-containing lipophilic triazine compound UV-screening agents L'OREAL (FR) 2008-06-12 US disclosed
EP-1891079-A1 PHOTOSTABILIZATION OF A DIBENZOYLMETHANE BY A SILICON- CONTAINING S-TRIAZINE SUBSTITUTED WITH TWO AMINOBENZOATE OR AMINOBENZAMIDE GROUPS; PHOTOPROTECTIVE COMPOSITIONS. NOVEL SILICON-CONTAINING S-TRIAZINE COMPOUNDS L'Oréal (FR) 2008-02-27 EP disclosed
WO-2006128732-A1 PHOTOSTABILIZATION OF A DIBENZOYLMETHANE BY A SILICON- CONTAINING S-TRIAZINE SUBSTITUTED WITH TWO AMINOBENZOATE OR AMINOBENZAMIDE GROUPS; PHOTOPROTECTIVE COMPOSITIONS. NOVEL SILICON-CONTAINING S-TRIAZINE COMPOUNDS L'OREAL (FR) 2006-12-07 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 (4 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-20080145324-A1 UV-photoprotective compositions comprising diebenzoylmethane screening agents and silicon-containing s-triazine compounds substituted with two aminobenzoate or aminobenzamide groups TST, TYR, DDT LMNA 2847/4885ALDH1A1 1477/4885TSHR 4029/4885
US-20120201767-A1 COMPOSITION COMPRISING A SCREENING AGENT OF THE LIPOPHILIC 2-HYDROXYBENZOPHENONE TYPE AND A SILICON-COMPRISING S-TRIAZINE SUBSTITUTED BY AT LEAST TWO ALKYLAMINOBENZOATE GROUPS STS, TST, ARSA LMNA 2221/4885ALDH1A1 370/4885TSHR 2096/4885
US-20100003207-A1 Photoprotective compositions comprising photosensitive 1,3,5-triazine compounds, dibenzoylmethane compounds and siliceous s-triazines substituted with two aminobenzoate or aminobenzamide groups CUTA, TST, DSG1 LMNA 2246/4885ALDH1A1 3175/4885TSHR 4196/4885
US-20170135933-A1 PHOTOPROTECTIVE COMPOSITIONS COMPRISING PHOTOSENSITIVE 1,3,5-TRIAZINE COMPOUNDS, DIBENZOYLMETHANE COMPOUNDS AND SILICEOUS S-TRIAZINES SUBSTITUTED WITH TWO AMINOBENZOATE OR AMINOBENZAMIDE GROUPS CUTA, TST, DSG1 LMNA 2246/4885ALDH1A1 3175/4885TSHR 4196/4885

“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.