SCHEMBL3404643

SCHEMBL3404643

C=CCC(CO)(CO)CC=CO

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HIF1A Q16665 1/20 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
SCHEMBL1420447 0.87 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL45388 0.84 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL5006489 0.79
SCHEMBL5006496 0.79
SCHEMBL24603372 0.79 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL4556468 0.79 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
Alcohol SCHEMBL7187474 0.77 TSHR (0.35) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL3518097 0.70 TSHR (0.33) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL9318291 0.70 TSHR (0.33) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL24603363 0.68 TSHR (0.32) TSHRALDH1A1TP53CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1342471-B1 Nanocapsules based on polyol polyester, and cosmetic and dermatological compositions containing same OREAL (FR) 2005-06-08 EP claimed
US-20030224060-A1 Polyester polyol nanocapsules, compositions thereof, and methods of use L'OREAL (FR) 2003-12-04 US claimed
EP-1342471-A1 Nanocapsules based on polyol polyester, and cosmetic and dermatological compositions containing same L'OREAL (FR) 2003-09-10 EP claimed
EP-2011565-B1 Core/skin type capsules and preparation method OREAL (FR) 2010-11-03 EP disclosed
US-20090047341-A1 CAPSULES OF CORE/SHELL TYPE AND PREPARATION PROCESS L'OREAL (FR) 2009-02-19 US disclosed
EP-2011565-A1 Core/skin type capsules and preparation method L'OREAL (FR) 2009-01-07 EP disclosed
EP-1342471-B1 Nanocapsules based on polyol polyester, and cosmetic and dermatological compositions containing same OREAL (FR) 2005-06-08 EP disclosed
US-20030224060-A1 Polyester polyol nanocapsules, compositions thereof, and methods of use L'OREAL (FR) 2003-12-04 US disclosed
EP-1342471-A1 Nanocapsules based on polyol polyester, and cosmetic and dermatological compositions containing same L'OREAL (FR) 2003-09-10 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-20090047341-A1 CAPSULES OF CORE/SHELL TYPE AND PREPARATION PROCESS SAMM50, CFH, DOHH TSHR 4742/4885ALDH1A1 3090/4885TP53 2107/4885

“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.