SCHEMBL1746493

SCHEMBL1746493

O=C(c1ccc(F)cc1)c1ccc(C#Cc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.55
MMP9 P14780 1/20 0.55
MMP12 P39900 1/20 0.55
ALDH1A1 P00352 4/20 0.54
LMNA P02545 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HPGD P15428 2/20 0.54
ALPG P10696 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
USP2 O75604 1/20 0.54
HTT P42858 1/20 0.54
FFAR1 O14842 4/20 0.50
LTA4H P09960 1/20 0.50
SRD5A2 P31213 1/20 0.47
APP P05067 2/20 0.46
GRM5 P41594 1/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
KDM4E B2RXH2 1/20 0.44
THRB P10828 1/20 0.44

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
SCHEMBL7715045 0.92 LTA4H (0.57) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL7717354 0.92 LTA4H (0.57) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL7716924 0.92 LTA4H (0.57) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL13284015 0.90 LMNA (0.49) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL4301156 0.88 L3MBTL1 (0.53) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL1744898 0.88 ALDH1A1 (0.64) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL13284137 0.87 CNR1 (0.51) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL7715052 0.86 ATM (0.46) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL6545360 0.86 ATM (0.46) MMP2MMP9MMP12ALDH1A1LMNA
SCHEMBL6545581 0.84 HNF4A (0.49) MMP2MMP9MMP12ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113416127-A Cross-linkable semi-crystalline polyether-ether-ketone, preparation method and application thereof, polyether-ether-ketone polymer alloy material and preparation method thereof 吉林大学 2021-09-21 CN claimed
US-8952200-B2 Liquid crystal oligomer, synthesis composition, preparation method thereof, and liquid crystal material BOE TECHNOLOGY GROUP CO., LTD. (CN) 2015-02-10 US claimed
US-20120264980-A1 LIQUID CRYSTAL OLIGOMER, SYNTHESIS COMPOSITION, PREPARATION METHOD THEREOF, AND LIQUID CRYSTAL MATERIAL BEIJING BOE DISPLAY TECHNOLOGY CO., LTD (CN) 2012-10-18 US claimed
CN-113416127-A Cross-linkable semi-crystalline polyether-ether-ketone, preparation method and application thereof, polyether-ether-ketone polymer alloy material and preparation method thereof 吉林大学 2021-09-21 CN disclosed
US-20210188758-A1 PHENOXY ACETIC ACIDS AND PHENYL PROPIONIC ACIDS AS PPAR DELTA AGONISTS VTVX HOLDINGS II LLC 2021-06-24 US disclosed
US-10947180-B2 Phenoxy acetic acids and phenyl propionic acids as PPAR delta agonists VTV THERAPEUTICS LLC (US) 2021-03-16 US disclosed
US-20200215073-A1 PHENOXY ACETIC ACIDS AND PHENYL PROPIONIC ACIDS AS PPAR DELTA AGONISTS HIGH POINT PHARMACEUTICALS, LLC 2020-07-09 US disclosed
EP-3080189-B1 POLYMERIC MATERIALS VICTREX MFG LTD (GB) 2020-02-12 EP disclosed
US-10471066-B2 Phenoxy acetic acids and phenyl propionic acids as PPAR delta agonists VTV THERAPEUTICS LLC (US) 2019-11-12 US disclosed
US-20180071304-A1 Phenoxy Acetic Acids and Phenyl Propionic Acids as PPAR Delta Agonists HIGH POINT PHARMACEUTICALS, LLC 2018-03-15 US disclosed
US-9855274-B2 Phenoxy acetic acids and phenyl propionic acids as PPAR delta agonists VTV THERAPEUTICS LLC (US) 2018-01-02 US disclosed
US-5965687-A USING A TRIFUNCTIONAL PHENOL IN THE POLYMERIZATION OF POLYETHER MONOMERS TO FORM BRANCHED OR STAR POLYMERS; LOW MELTING POINTS; IMPROVED CHEMICAL RESISTANCE AND MECHANICAL PROPERTIES; RESIN TRANSFER MOLDING AND RESIN FILM INFUSION THE UNITED STATES OF AMERICA REPRESENTED BY THE ADMINSTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1999-10-12 US disclosed
WO-1998040422-A1 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1998-09-17 WO disclosed
US-5599993-A USED FOR ENDCAPPING POLYIMIDES WITH EXCELLENT SOLVENT AND CHEMICAL RESISTANCE, HIGH STRENGTH AND MODULUS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1997-02-04 US disclosed
US-5446204-A Enhance density of thermosetting materials THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1995-08-29 US disclosed
US-5426234-A Compounds which are heat resistant at lower temperatures, but which polymerize at higher temperatures, also as reactive diluents or end groups for crosslinking THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1995-06-20 US disclosed
US-5412066-A Adhesives THER UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1995-05-02 US disclosed
US-5312994-A Phenylethynyl endcapping reagents and reactive diluents THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1994-05-17 US disclosed
US-5268444-A Polyketone ethers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1993-12-07 US disclosed
US-5268444-A Polyketone ethers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1993-12-07 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 (6 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-10471066-B2 Phenoxy acetic acids and phenyl propionic acids as PPAR delta agonists PPARG, PPARA, PPARD MMP2 3228/4885MMP9 4339/4885MMP12 2672/4885
US-10947180-B2 Phenoxy acetic acids and phenyl propionic acids as PPAR delta agonists PPARG, PPARA, PPARD MMP2 3228/4885MMP9 4339/4885MMP12 2672/4885
US-20180071304-A1 Phenoxy Acetic Acids and Phenyl Propionic Acids as PPAR Delta Agonists PPARG, PPARA, PPARD MMP2 3228/4885MMP9 4339/4885MMP12 2672/4885
US-20200215073-A1 PHENOXY ACETIC ACIDS AND PHENYL PROPIONIC ACIDS AS PPAR DELTA AGONISTS PPARG, PPARA, PPARD MMP2 3228/4885MMP9 4339/4885MMP12 2672/4885
US-20210188758-A1 PHENOXY ACETIC ACIDS AND PHENYL PROPIONIC ACIDS AS PPAR DELTA AGONISTS PPARG, PPARA, PPARD MMP2 3228/4885MMP9 4339/4885MMP12 2672/4885
US-20120264980-A1 LIQUID CRYSTAL OLIGOMER, SYNTHESIS COMPOSITION, PREPARATION METHOD THEREOF, AND LIQUID CRYSTAL MATERIAL RNMT, DNMT3A, DNMT1 MMP2 3765/4885MMP9 3195/4885MMP12 4740/4885

“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.