SCHEMBL73303

SCHEMBL73303

[CH2]CCOc1ccc(O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.55
NR5A1 Q13285 1/20 0.55
DRD4 P21917 2/20 0.48
DRD2 P14416 1/20 0.48
DRD3 P35462 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
CYP2C19 P33261 1/20 0.48
PTGS2 P35354 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HIF1A Q16665 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
APP P05067 2/20 0.46
CYP19A1 P11511 1/20 0.46

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
SCHEMBL7465840 0.86 NR5A1 (0.62) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL226548 0.85 LTA4H (0.64) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL17784353 0.85 NR5A1 (0.66) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL17784372 0.85 NR5A1 (0.66) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL17784366 0.85 NR5A1 (0.66) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL2473527 0.82 LTA4H (0.68) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL2470706 0.82 NR5A1 (0.75) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL194336 0.80 LTA4H (0.52) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL16902827 0.80 NR5A1 (0.79) LTA4HNR5A1DRD4DRD2DRD3
SCHEMBL1129755 0.80 NR5A1 (0.79) LTA4HNR5A1DRD4DRD2DRD3

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 105 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10913855-B2 Silicon-containing heterocyclic compound, and quencher FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2021-02-09 US disclosed
CN-108473784-B Polyfunctional polymerizable compound and coloring composition 富士胶片和光纯药株式会社 2021-01-12 CN disclosed
CN-109071960-B Silicon-containing heterocyclic matting agents, compounds and polymers 富士胶片和光纯药株式会社 2021-01-12 CN disclosed
EP-3165541-B1 GRAFT POLYMER, RESIN COLORED MATTER, METHOD FOR PRODUCING SAME, AND RESIN COMPOSITION CONTAINING RESIN COLORED MATTER FUJIFILM WAKO PURE CHEMICAL CORP (JP) 2020-09-09 EP disclosed
US-10696898-B2 Reverse photochromic compound FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2020-06-30 US disclosed
CN-111218126-A Matting agent, compound and polymer 富士胶片和光纯药株式会社 2020-06-02 CN disclosed
CN-107001807-B Compound and polymer 富士胶片和光纯药株式会社 2020-04-03 CN disclosed
US-10588895-B2 Quinuclidine derivatives and medicinal compositions containing the same ALMIRALL, S.A. (ES) 2020-03-17 US disclosed
CN-110234642-A Nagative photochromism compound 富士胶片和光纯药株式会社 2019-09-13 CN disclosed
US-10377713-B2 Quencher FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-08-13 US disclosed
EP-1353919-A2 NOVEL QUINUCLIDINE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Almirall Prodesfarma AG (CH) 2003-10-22 EP disclosed
EP-1345937-A1 QUINUCLIDINE CARBAMATE DERIVATIVES AND THEIR USE AS M3 ANTAGONISTS Almirall Prodesfarma, S.A. (ES) 2003-09-24 EP disclosed
WO-2003066063-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING 17ALPHA-FURANYLESTERS OF 17BETA-CARBOTHIOATE ANDROSTANES WITH A MUSCARINIC RECEPTOR ANTAGONIST GLAXO GROUP LIMITED (GB) 2003-08-14 WO disclosed
EP-1200431-B1 QUINUCLIDINE DERIVATIVES AND THEIR USE AS MUSCARINIC M3 RECEPTORS LIGANDS ALMIRALL PRODESFARMA AG (CH) 2003-03-26 EP disclosed
US-20030055080-A1 For manufacture of medicament for use in therapy of respiratory, urinary or gastrointestinal disease ALMIRALL, S.A. (ES) 2003-03-20 US disclosed
CN-1373760-A Quinuclidine derivatives as muscarinic M3 receptor ligands and uses thereof ALMIRALL PRODESFARMA SA (ES) 2002-10-09 CN disclosed
WO-2002053564-A2 QUINUCLIDINE DERIVATIVES AND THEIR USE AS M3 ANTAGONISTS ALMIRALL PRODESFARMA AG (CH) 2002-07-11 WO disclosed
WO-2002051841-A1 QUINUCLIDINE CARBAMATE DERIVATIVES AND THEIR USE AS M3 ANTAGONISTS ALMIRALL PRODESFARMA AG (CH) 2002-07-04 WO disclosed
EP-1200431-A2 QUINUCLIDINE DERIVATIVES AND THEIR USE AS MUSCARINIC M3 RECEPTOR LIGANDS Almirall Prodesfarma, S.A. (ES) 2002-05-02 EP disclosed
WO-2001004118-A2 QUINUCLIDINE DERIVATIVES AND THEIR USE AS MUSCARINIC M3 RECEPTOR LIGANDS ALMIRALL PRODESFARMA S.A. (ES) 2001-01-18 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 (5 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-10696898-B2 Reverse photochromic compound CRY1, CRY2, C3AR1 LTA4H 64/4885NR5A1 3408/4885DRD4 350/4885
US-10377713-B2 Quencher AHR, GFER, AKR1A1 LTA4H 1113/4885NR5A1 124/4885DRD4 839/4885
US-20030055080-A1 For manufacture of medicament for use in therapy of respiratory, urinary or gastrointestinal disease NR1H4, CHRM3, CHRM4 LTA4H 972/4885NR5A1 230/4885DRD4 825/4885
US-10913855-B2 Silicon-containing heterocyclic compound, and quencher ANXA11, ANXA1, ORAI2 LTA4H 798/4885NR5A1 274/4885DRD4 477/4885
US-10588895-B2 Quinuclidine derivatives and medicinal compositions containing the same CHRM3, QDPR, CHRM2 LTA4H 210/4885NR5A1 2887/4885DRD4 935/4885

“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.