SCHEMBL21023901

SCHEMBL21023901

C[C@H](Cc1cccc(O)c1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.52
ESR2 Q92731 1/20 0.52
SLC6A2 P23975 1/20 0.51
SLC6A4 P31645 1/20 0.51
SLC6A3 Q01959 1/20 0.51
OPRK1 P41145 7/20 0.48
OPRM1 P35372 6/20 0.48
OPRD1 P41143 6/20 0.48
ADRB1 P08588 1/20 0.47
MIF P14174 1/20 0.47
HTR2A P28223 1/20 0.47
ADRA1A P35348 1/20 0.47
HTR2B P41595 1/20 0.47
NR3C2 P08235 1/20 0.46
ENPP2 Q13822 1/20 0.46
DRD2 P14416 3/20 0.45
DRD3 P35462 3/20 0.45
TRPA1 O75762 1/20 0.43

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
SCHEMBL10333851 1.00 ESR1 (0.52) ESR1ESR2SLC6A2SLC6A4SLC6A3
SCHEMBL29121411 0.91 ADRB1 (0.49) ESR1ESR2SLC6A2SLC6A4SLC6A3
SCHEMBL22031056 0.89 ESR1 (0.67) ESR1ESR2SLC6A2OPRK1OPRM1
SCHEMBL28041147 0.89 ESR1 (0.52) ESR1ESR2SLC6A2SLC6A4SLC6A3
SCHEMBL3684825 0.87 TAAR1 (0.50) ESR1ESR2SLC6A2SLC6A4SLC6A3
SCHEMBL10518882 0.85 ESR1 (0.51) ESR1ESR2OPRK1OPRM1OPRD1
SCHEMBL20718701 0.84 ESR1 (0.47) ESR1ESR2
SCHEMBL25381540 0.83 TAAR1 (0.52) ESR1ESR2SLC6A2SLC6A4SLC6A3
SCHEMBL20906818 0.83 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3OPRK1OPRM1
SCHEMBL144607 0.81 ESR1 (0.71) ESR1ESR2SLC6A2SLC6A3OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11253455-B2 Carboxylated polyphenol derivatives and their cosmetic use L'ORÉAL (FR) 2022-02-22 US disclosed
US-20190151215-A1 CARBOXYLATED POLYPHENOL DERIVATIVES AND THEIR COSMETIC USE L'ORÉAL (FR) 2019-05-23 US 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 (2 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-20190151215-A1 CARBOXYLATED POLYPHENOL DERIVATIVES AND THEIR COSMETIC USE H1-0, GLA, NQO1 ESR1 999/4885ESR2 1027/4885SLC6A2 4654/4885
US-11253455-B2 Carboxylated polyphenol derivatives and their cosmetic use H1-0, GLA, NQO1 ESR1 999/4885ESR2 1027/4885SLC6A2 4654/4885

“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.