SCHEMBL4353419

SCHEMBL4353419

CCCCCCCCCC1(CC(=O)O)OCCO1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 7/20 0.41
PPARD Q03181 7/20 0.41
PPARA Q07869 7/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
PTPN1 P18031 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
MEN1 O00255 1/20 0.41
ESR1 P03372 1/20 0.41
ALOX15 P16050 1/20 0.41
PDE4A P27815 1/20 0.41
KMT2A Q03164 1/20 0.41
PDE3A Q14432 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL13124953 1.00 GPR84 (0.41) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL8948233 1.00 GPR84 (0.41) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL13124944 0.98 AKR1B1 (0.39) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL3254927 0.85 FFAR3 (0.32) TSHRKMT2A
SCHEMBL30143360 0.84 MEN1 (0.37) MEN1KMT2A
SCHEMBL23281437 0.82 FOLH1 (0.38) HDAC11
SCHEMBL25428919 0.82 ALDH1A1 (0.39) TSHRALDH1A1
SCHEMBL24813450 0.82 LMNA (0.41) HDAC11TSHRALDH1A1MEN1ALOX15
SCHEMBL14169233 0.81 POLB (0.38)
SCHEMBL14779365 0.80 TSHR (0.40) TSHR

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108191746-B Hydroxypyridones compound and preparation method and application thereof 暨南大学 2020-06-16 CN claimed
US-20220411397-A1 ANALOGUES OF N-ACYL-HOMOSERINE LACTONES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME ECOLE NORMALE SUPERIEURE (FR) 2022-12-29 US disclosed
US-20220411397-A1 ANALOGUES OF N-ACYL-HOMOSERINE LACTONES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME ECOLE NORMALE SUPERIEURE (FR) 2022-12-29 US disclosed
CN-115209891-A Analogs of N-acyl-homoserine lactones and pharmaceutical compositions containing the same 索邦大学 2022-10-18 CN disclosed
EP-4048258-A1 ANALOGUES OF N-ACYL-HOMOSERINE LACTONES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME SORBONNE UNIVERSITE (FR) 2022-08-31 EP disclosed
WO-2021078952-A1 ANALOGUES OF N-ACYL-HOMOSERINE LACTONES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME SORBONNE UNIVERSITE (FR) 2021-04-29 WO disclosed
CN-108191746-B Hydroxypyridones compound and preparation method and application thereof 暨南大学 2020-06-16 CN disclosed
US-8436210-B2 Amide compound and bacterial disease control agent for agricultural and horticultural use THE UNIVERSITY OF TOKYO (JP) 2013-05-07 US disclosed
US-20100261920-A1 AMIDE COMPOUND AND BACTERIAL DISEASE CONTROL AGENT FOR AGRICULTURAL AND HORTICULTURAL USE THE UNIVERSITY OF TOKYO (JP) 2010-10-14 US disclosed
US-20100261920-A1 AMIDE COMPOUND AND BACTERIAL DISEASE CONTROL AGENT FOR AGRICULTURAL AND HORTICULTURAL USE THE UNIVERSITY OF TOKYO (JP) 2010-10-14 US disclosed
EP-2077109-A1 AMIDE COMPOUND, SALT THEREOF, AND BIOFILM REMOVER USING THEM The University of Tokyo (JP) 2009-07-08 EP disclosed
US-7498292-B2 Combinatorial libraries of autoinducer analogs, autoinducer agonists and antagonists, and methods of use thereof THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2009-03-03 US disclosed
US-20080241081-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2008-10-02 US disclosed
US-20080241081-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2008-10-02 US disclosed
US-20080027115-A1 COMBINATORIAL LIBRARIES OF AUTOINDUCER ANALOGS, AUTOINDUCER AGONISTS AND ANTAGONISTS, AND METHODS OF USE THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2008-01-31 US disclosed
CN-1839204-A Combinatorial libraries of autoinducer analogs, autoinducer agonists and antagonists, and methods of use thereof UNIV NEW YORK (US) 2006-09-27 CN disclosed
EP-1578359-A2 COMBINATORIAL LIBRARIES OF AUTOINDUCER ANALOGS, AUTOINDUCER AGONISTS AND ANTAGONISTS, AND METHODS OF USE THEREOF The Research Foundation of the State University of New York (US) 2005-09-28 EP disclosed
US-20040115732-A1 Combinatorial libraries of autoinducer analogs, autoinducer agonists and antagonists, and methods of use thereof RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK, THE 2004-06-17 US disclosed
WO-2004016213-A2 COMBINATORIAL LIBRARIES OF AUTOINDUCER ANALOGS, AUTOINDUCER AGONISTS AND ANTAGONISTS, AND METHODS OF USE THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2004-02-26 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-20080241081-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME H1-0, H1-10, H1-4 GPR84 2722/4885PPARG 3936/4885PPARD 3800/4885
US-20080027115-A1 COMBINATORIAL LIBRARIES OF AUTOINDUCER ANALOGS, AUTOINDUCER AGONISTS AND ANTAGONISTS, AND METHODS OF USE THEREOF QRFPR, CASR, BLVRB GPR84 110/4885PPARG 2852/4885PPARD 2324/4885
US-20100261920-A1 AMIDE COMPOUND AND BACTERIAL DISEASE CONTROL AGENT FOR AGRICULTURAL AND HORTICULTURAL USE BROX, NAAA, H1-2 GPR84 1224/4885PPARG 3077/4885PPARD 4371/4885
US-20220411397-A1 ANALOGUES OF N-ACYL-HOMOSERINE LACTONES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AHCYL1, LTC4S, AHCY GPR84 507/4885PPARG 1104/4885PPARD 945/4885

“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.