SCHEMBL3125861

SCHEMBL3125861

COC(=O)CCC(C)(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.67
ESR2 Q92731 3/20 0.67
ALDH1A1 P00352 2/20 0.67
CYP3A4 P08684 2/20 0.67
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
ESRRB O95718 1/20 0.44
CHEK1 O14757 1/20 0.42
FYN P06241 1/20 0.42
PDGFRB P09619 1/20 0.42
PIM1 P11309 1/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
GRK5 P34947 1/20 0.42
MAP2K2 P36507 1/20 0.42
MAPK8 P45983 1/20 0.42
CDK8 P49336 1/20 0.42
RPS6KA3 P51812 1/20 0.42
PRKX P51817 1/20 0.42
JAK3 P52333 1/20 0.42

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
SCHEMBL11210778 0.90 ESR1 (0.58) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL28137465 0.89 ESR1 (0.57) ESR1ESR2ALDH1A1CYP3A4CNR1
Valeric Acid SCHEMBL5788726 0.87 ESR1 (0.64) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL7122766 0.85 ESR1 (0.65) ESR1ESR2ALDH1A1CYP3A4CHEK1
SCHEMBL17577381 0.85 ALDH1A1 (0.51) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL8698880 0.84 ALDH1A1 (0.50) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL3131837 0.83 ESR1 (0.63) ESR1ESR2ALDH1A1CYP3A4CHEK1
SCHEMBL20717103 0.82 ESR1 (0.51) ESR1ESR2ALDH1A1CYP3A4ESRRB
SCHEMBL18470082 0.82 ESR1 (0.71) ESR1ESR2ALDH1A1CYP3A4CHEK1
SCHEMBL13588060 0.82 ALDH1A1 (0.47) ESR1ESR2ALDH1A1CYP3A4CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0846569-B1 Thermally-Responsive Record Material APPLETON PAPER INC (US) 2002-02-06 EP claimed
EP-0319283-B1 THERMALLY RESPONSIVE RECORD MATERIAL APPLETON PAPERS INC. (US) 1993-06-09 EP claimed
US-4895827-A Containing cinnamic metal salt APPLETON PAPERS INC. (US) 1990-01-23 US claimed
EP-0161105-B1 RECORD MATERIAL APPLETON PAPERS INC. (US) 1989-12-20 EP claimed
US-4870047-A RESISTANCE TO FADING OR ERASURE APPLETON PAPERS INC. (US) 1989-09-26 US claimed
EP-0319283-A2 Thermally responsive record material APPLETON PAPERS INC. (US) 1989-06-07 EP claimed
US-4820683-A COLORFASTNESS APPLETON PAPERS INC. (US) 1989-04-11 US claimed
EP-0100196-B1 THERMALLY RESPONSIVE RECORD MATERIAL APPLETON PAPERS INC. (US) 1986-07-30 EP claimed
EP-0161105-A2 Record material APPLETON PAPERS INC. (US) 1985-11-13 EP claimed
US-4535347-A HYDROXYANILIDES, PHENOLIC DEVELOPERS, CHROMOGENIC COMPOUNDS; BLOOMRESISTANCE APPLETON PAPERS INC. (US) 1985-08-13 US claimed
US-4470057-A CHROMOGENIC COMPOUND, ACIDIC DEVELOPERS, AND PHENYLHYDROXYNAPHTHOATE APPLETON PAPERS INC. (US) 1984-09-04 US claimed
EP-0100196-A2 Thermally responsive record material APPLETON PAPERS INC. (US) 1984-02-08 EP claimed
EP-4259610-B1 CATALYSTS FOR BENZOXAZINE LUXEMBOURG INST SCIENCE & TECH LIST (LU) 2024-09-18 EP disclosed
US-20240025867-A1 CATALYSTS FOR BENZOXAZINE LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2024-01-25 US disclosed
US-11859077-B2 Solvent-less ionic liquid epoxy resin ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2024-01-02 US disclosed
US-11859077-B2 Solvent-less ionic liquid epoxy resin ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2024-01-02 US disclosed
US-4535347-A HYDROXYANILIDES, PHENOLIC DEVELOPERS, CHROMOGENIC COMPOUNDS; BLOOMRESISTANCE APPLETON PAPERS INC. (US) 1985-08-13 US disclosed
US-4510227-A Light-sensitive aqueous developable copying material and product by coating process thereof utilizing polysiloxane and alkylene oxide copolymer as coating aid HOECHST AKTIENGESELLSCHAFT (DE) 1985-04-09 US disclosed
US-4487823-A Light-sensitive copying material and process for the manufacture thereof utilizing non-ionic fluorinated ester surfactant HOECHST AKTIENGESELLSCHAFT (DE) 1984-12-11 US disclosed
US-4470057-A CHROMOGENIC COMPOUND, ACIDIC DEVELOPERS, AND PHENYLHYDROXYNAPHTHOATE APPLETON PAPERS INC. (US) 1984-09-04 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 (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-20240025867-A1 CATALYSTS FOR BENZOXAZINE AOX1, XDH, FOS ESR1 668/4885ESR2 3626/4885ALDH1A1 242/4885

“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.