2-Hydroxybenzoic Acid Butyl Ester

2-Hydroxybenzoic Acid Butyl Ester

SCHEMBL5381776

CC(O)Oc1ccccc1.CCCCOC(=O)c1ccccc1O.CCCOC(=O)c1ccccc1O.CCOC(=O)c1ccccc1O.COC(=O)c1ccccc1O

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 10/20 0.48
TDP1 Q9NUW8 6/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
ALDH1A1 P00352 6/20 0.47
MAPK1 P28482 3/20 0.47
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
CYP3A4 P08684 2/20 0.45
TP53 P04637 1/20 0.44
HSD17B10 Q99714 3/20 0.44
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
MAPK10 P53779 1/20 0.41
SIRT5 Q9NXA8 1/20 0.40

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
Butylparaben SCHEMBL1131653 0.84 ESR1 (0.55) TSHRTDP1ALDH1A1MAPK1LMNA
Methyl Salicylate SCHEMBL27645401 0.82 TSHR (0.67) TSHRTDP1ALDH1A1LMNAHSD17B10
Methyl Salicylate SCHEMBL27697194 0.80 TSHR (0.56) TSHRTDP1ALDH1A1MAPK1LMNA
Butylparaben SCHEMBL3832690 0.80 TSHR (0.50) TSHRTDP1ALDH1A1MAPK1LMNA
Methyl Salicylate SCHEMBL9229811 0.80 TSHR (0.71) TSHRTDP1L3MBTL1ALDH1A1MAPK1
Propylparaben SCHEMBL8509467 0.79 ESR1 (0.56) TSHRTDP1ALDH1A1MAPK1LMNA
Ethyl Salicylate SCHEMBL27816869 0.78 ALDH1A1 (0.71) TSHRTDP1L3MBTL1ALDH1A1MAPK1
2-Hydroxybenzoic Acid Butyl Ester SCHEMBL21753665 0.77 TSHR (0.75) TSHRTDP1L3MBTL1ALDH1A1MAPK1
2-Hydroxybenzoic Acid Butyl Ester SCHEMBL29672357 0.77 TSHR (0.75) TSHRTDP1L3MBTL1ALDH1A1MAPK1
2-Hydroxybenzoic Acid Butyl Ester SCHEMBL27913511 0.77 TSHR (0.75) TSHRTDP1L3MBTL1ALDH1A1MAPK1

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-7169193-B2 Use of sugar surfactants and fatty acid partial glycerides HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2007-01-30 US disclosed
US-20050198747-A1 Use of cationic starch derivatives for dye retention HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2005-09-15 US disclosed
US-6858216-B2 Cosmetic agent containing 2-furanone derivatives HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-02-22 US disclosed
US-20030206933-A1 Cosmetic agent containing 2-furanone derivatives HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2003-11-06 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-20030206933-A1 Cosmetic agent containing 2-furanone derivatives PRDX5, TRPA1, SRD5A2 TSHR 4178/4885TDP1 2610/4885L3MBTL1 4877/4885
US-20050198747-A1 Use of cationic starch derivatives for dye retention CUTA, GHDC, ALG1 TSHR 2594/4885TDP1 2272/4885L3MBTL1 3938/4885

“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.