SCHEMBL5380593

SCHEMBL5380593

O=C(O)CCC1C(=O)Nc2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.70
IDO1 P14902 7/20 0.64
TDO2 P48775 3/20 0.58
GSK3B P49841 2/20 0.54
SRC P12931 2/20 0.52
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HTR7 P34969 1/20 0.49

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
SCHEMBL8998981 0.91 EGFR (0.72) EGFRIDO1TDO2GSK3BSRC
SCHEMBL1302976 0.83 EGFR (0.69) EGFRIDO1TDO2GSK3BMAPT
SCHEMBL29437202 0.83 EGFR (0.69) EGFRIDO1TDO2GSK3BMAPT
SCHEMBL1388746 0.83 EGFR (1.00) EGFRIDO1TDO2GSK3BSRC
SCHEMBL320134 0.82 IDO1 (0.57) EGFRIDO1TDO2GSK3BSRC
SCHEMBL397709 0.81 IDO1 (0.70) EGFRIDO1TDO2GSK3BSRC
SCHEMBL24811418 0.81 EGFR (0.51) EGFRIDO1TDO2GSK3BSRC
SCHEMBL24811063 0.81 EGFR (0.51) EGFRIDO1TDO2GSK3BSRC
SCHEMBL10789931 0.81 IDO1 (0.69) EGFRIDO1TDO2GSK3BSRC
SCHEMBL8999062 0.80 MAPT (0.56) EGFRIDO1TDO2GSK3BSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0731648-B1 FLAVOURING COMPOSITIONS AND METHOD FIRMENICH & CIE (CH) 2003-03-26 EP claimed
JP-2002542797-A 2002-12-17 JP claimed
US-6403144-B1 LECITHIN ANTISTICK AGENT, NUCLEOTIDE FLAVOR ENHANCER, POLYDIMETHYLSILOXANE ANTIFOAM AGENT, RELATIVELY LOW AMOUNTS YET PROVIDE IMPROVED FLAVOR, TEXTURE AND AROMA OF COOKING OIL, COOKING SPRAY, AND SHORTENING THE PROCTER & GAMBLE CO. 2002-06-11 US claimed
US-20020045001-A1 Food preparation compositions THE J.M. SMUCKER COMPANY 2002-04-18 US claimed
EP-1176879-A1 FOOD PREPARATION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2002-02-06 EP claimed
WO-2000065933-A1 FOOD PREPARATION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-11-09 WO claimed
EP-3806661-B1 USE OF ANTAGONISTS OF T2R54 FIRMENICH INCORPORATED (US) 2025-07-02 EP disclosed
EP-4566459-A2 ANTAGONISTS OF T2R54 AND COMPOSITIONS AND USES THEREOF Firmenich Incorporated (US) 2025-06-11 EP disclosed
US-12295396-B2 Antagonists of T2R54 and compositions and uses thereof FIRMENICH INCORPORATED (US) 2025-05-13 US disclosed
CN-113194742-B Antagonists of T2R54, compositions thereof and uses thereof 弗门尼舍公司 2024-09-27 CN disclosed
US-20240114942-A1 Antagonists of T2R54 and Compositions and Uses Thereof FIRMENICH INCORPORATED (US) 2024-04-11 US disclosed
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
US-11871772-B2 Antagonists of T2R54 and compositions and uses thereof FIRMENICH INCORPORATED (US) 2024-01-16 US disclosed
US-6287620-B1 Flavor enhancing methods FIRMENICH SA (CH) 2001-09-11 US disclosed
WO-2000065933-A1 FOOD PREPARATION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-11-09 WO disclosed
WO-2000065926-A1 FLAVOR ENHANCING OILS THE PROCTER & GAMBLE COMPANY (US) 2000-11-09 WO disclosed
EP-0731648-A1 FLAVOURING COMPOSITIONS AND METHOD FIRMENICH SA (CH) 1996-09-18 EP disclosed
WO-1996010927-A1 FLAVOURING COMPOSITIONS AND METHOD FIRMENICH S.A. (CH) 1996-04-18 WO disclosed
EP-0654024-A1 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES WARNER-LAMBERT COMPANY (US) 1995-05-24 EP disclosed
WO-1994003427-A1 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES WARNER-LAMBERT COMPANY (US) 1994-02-17 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 (4 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-20240108040-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 EGFR 4124/4885IDO1 4526/4885TDO2 4292/4885
US-11871772-B2 Antagonists of T2R54 and compositions and uses thereof TAS2R50, TAS2R30, TAS2R60 EGFR 431/4885IDO1 2597/4885TDO2 1991/4885
US-12295396-B2 Antagonists of T2R54 and compositions and uses thereof TAS2R50, TAS2R30, TAS2R60 EGFR 431/4885IDO1 2597/4885TDO2 1991/4885
US-20240114942-A1 Antagonists of T2R54 and Compositions and Uses Thereof TAS2R50, TAS2R30, TAS2R60 EGFR 431/4885IDO1 2597/4885TDO2 1991/4885

“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.