Pyrene

Pyrene

SCHEMBL5502107

CCCC(=O)O.O=C1CCC(=O)N1O.c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 3/20 0.46
CYP1A2 P05177 2/20 0.46
GLA P06280 1/20 0.46
POLB P06746 1/20 0.46
CYP2D6 P10635 1/20 0.46
FFAR3 O14843 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
MAPT P10636 2/20 0.38
AKR1B1 P15121 1/20 0.38
ALOX15 P16050 1/20 0.38
ERCC1 P07992 1/20 0.37
FEN1 P39748 1/20 0.37

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
Pyrene SCHEMBL30069714 0.84 HPGD (0.59) KMT2AMEN1KDM4EALDH1A1HPGD
Pyrene SCHEMBL38210 0.84 HPGD (0.59) KMT2AMEN1KDM4EALDH1A1HPGD
Butyric Acid SCHEMBL11972727 0.84 FFAR3 (0.54) KMT2AMEN1ALDH1A1HSD17B10FFAR3
Pyrene SCHEMBL9435802 0.84 HPGD (0.59) KMT2AMEN1KDM4EALDH1A1HPGD
Butyric Acid SCHEMBL1284593 0.82 KMT2A (0.47) KMT2AMEN1KDM4EALDH1A1HPGD
Pyrene SCHEMBL9879158 0.82 HPGD (0.57) KMT2AMEN1KDM4EALDH1A1HPGD
Pyrene SCHEMBL28259646 0.82 HPGD (0.57) KMT2AMEN1KDM4EALDH1A1HPGD
Pyrene SCHEMBL19358800 0.82 ERCC1 (0.50) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL5352777 0.81 KMT2A (0.75) KMT2AMEN1KDM4EALDH1A1HPGD
Pyrene SCHEMBL28116952 0.81 HPGD (0.56) KMT2AMEN1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977767-B1 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS INC (US) 2007-09-19 EP disclosed
US-20050074771-A1 Carbamate-derivatized nucleosides and oligonucleosides ISIS PHARMACEUTICALS, INC. 2005-04-07 US disclosed
US-6803198-B2 COMPOUND FOR USE IN HUMAN THERAPEUTICS AND DIAGNOSTICS ISIS PHARMACEUTICALS, INC. 2004-10-12 US disclosed
US-6639062-B2 Oligonucleotides which elicit ribonuclease for cleavage in complementary nucleic acid strand, having increased binding affinity/nuclease resistance; for medical diagnosis, gene therapy ISIS PHARMACEUTICALS, INC. 2003-10-28 US disclosed
US-20030088079-A1 AMINOOXY-MODIFIED NUCLEOSIDIC COMPOUNDS AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM IONIS PHARMACEUTICALS, INC. 2003-05-08 US disclosed
EP-0977767-A4 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS INC (US) 2003-04-23 EP disclosed
US-20030039977-A1 Carbamate-derivatized nucleosides and oligonucleosides ISIS PHARMACEUTICALS, INC. 2003-02-27 US disclosed
EP-1102783-A4 AMINOOXY-MODIFIED NUCLEOSIDIC COMPOUNDS AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM ISIS PHARMACEUTICALS INC (US) 2002-07-31 EP disclosed
US-6322987-B1 FOR TREATING AN ANIMAL HAVING A DISEASE CHARACTERIZED BY UNDESIRED PRODUCTION OF PROTEIN ISIS PHARMACEUTICALS, INC. 2001-11-27 US disclosed
EP-1102783-A1 AMINOOXY-MODIFIED NUCLEOSIDIC COMPOUNDS AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM ISIS PHARMACEUTICALS, INC. (US) 2001-05-30 EP disclosed
US-6172209-B1 MOLECULAR HYBRIDIZATION, GENETIC ENGINEERING; NUCLEASE RESISTANCE ISIS PHARMACEUTICALS INC. 2001-01-09 US disclosed
US-6166188-A Carbamate-derivatized nucleosides and oligonucleosides ISIS PHARMACEUTICALS, INC. (US) 2000-12-26 US disclosed
US-6127533-A SPECIFICALLY HYBRIDIZABLE WITH A SELECTED SEQUENCE OF RNA OR DNA; DIAGNOSIS OF DISEASES ISIS PHARMACEUTICALS, INC. (US) 2000-10-03 US disclosed
US-6111085-A COMPOUND HAVING AT LEAST ONE NUCLEOSIDE WITH A DERIVATIVE AT THE 2'-O OR 3'-O POSITION; FOR IMPROVED PROPERTIES AND CONJUGATION OF FUNCTIONAL MOIETIES SUCH AS STEROIDS, REPORTER MOLECULES, REPORTER ENZYMES, LIPOPHILIC MOLECULES ISIS PHARMACEUTICALS, INC. (US) 2000-08-29 US disclosed
WO-2000008042-A1 AMINOOXY-MODIFIED NUCLEOSIDIC COMPOUNDS AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM ISIS PHARMACEUTICALS, INC. (US) 2000-02-17 WO disclosed
EP-0977767-A1 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2000-02-09 EP disclosed
WO-1998035978-A9 AMINOOXY-MODIFIED OLIGONUCLEOTIDES 1999-01-14 WO disclosed
WO-1998035978-A1 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1998-08-20 WO disclosed
US-5332659-A Light emission-or absorbance-based binding assays for polynucleic acids THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1994-07-26 US disclosed
US-5314802-A Light emission- or absorbance-based binding assays THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1994-05-24 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 (3 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-20050074771-A1 Carbamate-derivatized nucleosides and oligonucleosides RNGTT, NUDT21, DUT KMT2A 1291/4885MEN1 2452/4885KDM4E 703/4885
US-20030039977-A1 Carbamate-derivatized nucleosides and oligonucleosides RNGTT, NUDT21, DUT KMT2A 1291/4885MEN1 2452/4885KDM4E 703/4885
US-20030088079-A1 AMINOOXY-MODIFIED NUCLEOSIDIC COMPOUNDS AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM HNRNPM, RNASEH1, HNRNPF KMT2A 3019/4885MEN1 4186/4885KDM4E 4139/4885

“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.