SCHEMBL5352777

SCHEMBL5352777

O=C(O)CCCc1ccc2ccc3cccc4ccc1c2c34.O=C1CCC(=O)N1O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.75
MEN1 O00255 2/20 0.75
KDM4E B2RXH2 4/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2D6 P10635 2/20 0.46
ALDH1A1 P00352 2/20 0.46
POLB P06746 2/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
FAAH O00519 1/20 0.41
S1PR5 Q9H228 2/20 0.40
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.37
ITPR1 Q14643 1/20 0.36
HDAC3 O15379 1/20 0.36
MAPK1 P28482 1/20 0.36
ADRA1A P35348 1/20 0.36
HDAC4 P56524 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL29441770 0.87 KMT2A (1.00) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL29385360 0.87 KMT2A (1.00) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL113945 0.87 KMT2A (1.00) KMT2AMEN1KDM4ECYP1A2CYP2D6
Hydrochloric Acid SCHEMBL19876090 0.85 KMT2A (0.97) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL27758819 0.85 KMT2A (0.97) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL27740724 0.85 KMT2A (0.97) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL10906640 0.84 KMT2A (0.94) KMT2AMEN1KDM4ECYP1A2CYP2D6
Succinimide SCHEMBL28533920 0.84 KMT2A (0.77) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL591648 0.83 KMT2A (0.91) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL8644297 0.83 KMT2A (0.91) KMT2AMEN1KDM4ECYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108026575-B Method for amplifying nucleic acid sequence 哈佛学院董事及会员团体 2022-08-19 CN disclosed
US-11121176-B2 Nearly 2D electronic microparticles MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-09-14 US disclosed
US-11078412-B2 Polyamine and tyramine analysis method using pyrene containing fluorescence derivatization reagent and excimer fluorescence SHIMADZU CORPORATION (JP) 2021-08-03 US disclosed
CN-111081476-B Biological photovoltaic cell and preparation method thereof 中国科学院化学研究所 2021-07-20 CN disclosed
CN-111081476-A Biological photovoltaic cell and preparation method thereof 中国科学院化学研究所 2020-04-28 CN disclosed
US-20180051205-A1 FLUORESCENCE DERIVATIZATION REAGENT AND AMINE ANALYSIS METHOD SHIZUOKA PREFECTURE PUBLIC UNIVERSITY CORPORATION (JP) 2018-02-22 US disclosed
US-20130183249-A1 Stimulus Sensitive Magnetic Nanocomposite Using Pyrene Polymer, and Contrast Medium Composition Containing the Nanocomposite INDUSTRY ACADEMIC COOPERATION FOUNDATION YOUNSEI UNIVERSITY (KR) 2013-07-18 US disclosed
US-20120264108-A1 Intracellular Molecular Delivery Based On Nanostructure Injectors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-10-18 US disclosed
US-7235650-B2 Derivatized oligonucleotides having improved uptake and other properties ISIS PHARMACEUTICALS, INC. (US) 2007-06-26 US disclosed
US-7223833-B1 Peptide nucleic acid conjugates ISIS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
EP-0724447-B1 DERIVATIZED OLIGONUCLEOTIDES HAVING IMPROVED UPTAKE ISIS PHARMACEUTICALS INC (US) 2003-05-07 EP disclosed
US-20030064492-A1 Derivatized oligonucleotides having improved uptake and other properties ISIS PHARMACEUTICALS, INC. 2003-04-03 US disclosed
US-20020177150-A1 Derivatized oligonucleotides having improved uptake and other properties ISIS PHARMACEUTICAL, INC. 2002-11-28 US disclosed
EP-0804456-B1 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS INC (US) 2002-08-21 EP disclosed
US-6395492-B1 MONITORING CELLULAR INTAKE OF ADJUSTED NUCLEOSIDES; OBTAIN ORGANISM, INCUBATE WITH ADJUSTED NUCLEOSIDES, MONITOR CELL FOR REPORTER SIGNAL, PRESENCE INDICATES INTAKE ISIS PHARMACEUTICALS, INC. 2002-05-28 US disclosed
US-6153737-A OLIGONUCLEOTIDES HAVING IMPROVED TRANSFER ACROSS CELLULAR MEMBRANES; FOR ASSAYING DISEASE STATES IN ANIMALS; HAVING IMPROVED TRANSFER AND UPTAKE PROPERTIES FOR TREATMENT OF DISEASES THROUGH MODULATION OF ACTIVITY OF DNA AND RNA ISIS PHARMACEUTICALS, INC. (US) 2000-11-28 US disclosed
EP-0804456-A4 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS INC (US) 1999-05-19 EP disclosed
EP-0804456-A1 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS, INC. (US) 1997-11-05 EP disclosed
WO-1996011205-A9 PEPTIDE NUCLEIC ACID CONJUGATES 1996-05-30 WO disclosed
WO-1996011205-A1 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS, INC. (US) 1996-04-18 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 (2 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-11078412-B2 Polyamine and tyramine analysis method using pyrene containing fluorescence derivatization reagent and excimer fluorescence SRM, PNMT, TH KMT2A 1393/4885MEN1 2818/4885KDM4E 1794/4885
US-20180051205-A1 FLUORESCENCE DERIVATIZATION REAGENT AND AMINE ANALYSIS METHOD PNMT, SRM, PAH KMT2A 483/4885MEN1 2602/4885KDM4E 773/4885

“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.