SCHEMBL6036879

SCHEMBL6036879

CCCCC1CNC(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
PDE4A P27815 2/20 0.45
MAPK1 P28482 2/20 0.45
PDE4D Q08499 2/20 0.45
KDM4E B2RXH2 2/20 0.45
LMNA P02545 2/20 0.45
PDE4B Q07343 2/20 0.45
TNF P01375 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
NFKB1 P19838 1/20 0.45
ALDH1A1 P00352 5/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL21538189 0.92 ALDH1A1 (0.49) MAPTMEN1KMT2APDE4AMAPK1
SCHEMBL8393292 0.92 ALDH1A1 (0.49) MAPTMEN1KMT2APDE4AMAPK1
SCHEMBL6036801 0.92 ALDH1A1 (0.49) MAPTMEN1KMT2APDE4AMAPK1
SCHEMBL9512889 0.92 ALDH1A1 (0.49) MAPTMEN1KMT2APDE4AMAPK1
SCHEMBL13254106 0.88 PDE4A (0.39) MAPTMEN1KMT2APDE4AMAPK1
SCHEMBL20647462 0.88
SCHEMBL6036805 0.88
SCHEMBL20640349 0.88
SCHEMBL25686596 0.79
SCHEMBL6036787 0.79

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
US-20030129191-A1 Pretargeting methods and compounds NEORX CORPORATION (US) 2003-07-10 US claimed
US-5624896-A Clearing agents useful in pretargeting methods NEORX CORPORATION (US) 1997-04-29 US claimed
WO-1995015978-A1 PRETARGETING METHODS AND COMPOUNDS NEORX CORPORATION (US) 1995-06-15 WO claimed
US-7060689-B2 Injection of chemical intermediates into mammalian cells; obtain cells, inject with ligand joined colloid, detect signal from ligand THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-06-13 US disclosed
US-6908903-B1 Cluster clearing agents ALETHEON PHARMACEUTICALS, INC. (US) 2005-06-21 US disclosed
EP-0906015-A4 LIVER RETENTION CLEARING AGENTS NEORX CORP (US) 2004-05-12 EP disclosed
US-20030129191-A1 Pretargeting methods and compounds NEORX CORPORATION (US) 2003-07-10 US disclosed
EP-0794788-B1 HEPATIC-DIRECTED COMPOUNDS AND REAGENTS FOR PREPARATION THEREOF NEORX CORP (US) 2003-05-14 EP disclosed
US-20020164648-A1 Injection of chemical intermediates into mammalian cells; obtain cells, inject with ligand joined colloid, detect signal from ligand BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2002-11-07 US disclosed
US-6416738-B1 ADMINISTERING TO A RECIPIENT A FIRST CONJUGATE COMPRISING A TARGETING MOIETY AND A MEMBER OF A LIGAND/ANTI-LIGAND BINDING PAIR, THEREAFTER ADMINISTERING TO THE RECIPIENT A CLEARING AGENT, ADMINISTERING SECOND CONJUGATE NEORX CORPORATION 2002-07-09 US disclosed
WO-2001005433-A2 DELIVERY AND RETENTION OF ACTIVITY AGENTS TO LYMPH NODES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2001-01-25 WO disclosed
US-5886143-A Hepatic-directed compounds and reagents for preparation thereof NEORX CORPORATION (US) 1999-03-23 US disclosed
WO-1997046098-A9 CLUSTER CLEARING AGENTS 1998-08-06 WO disclosed
WO-1997046099-A1 LIVER RETENTION CLEARING AGENTS NEORX CORPORATION (US) 1997-12-11 WO disclosed
WO-1997046098-A1 CLUSTER CLEARING AGENTS NEORX CORPORATION (US) 1997-12-11 WO disclosed
EP-0794788-A1 HEPATIC-DIRECTED COMPOUNDS AND REAGENTS FOR PREPARATION THEREOF NEORX CORPORATION (US) 1997-09-17 EP disclosed
US-5624896-A Clearing agents useful in pretargeting methods NEORX CORPORATION (US) 1997-04-29 US disclosed
EP-0743956-A1 PRETARGETING METHODS AND COMPOUNDS NeoRx (US) 1996-11-27 EP disclosed
WO-1996017613-A1 HEPATIC-DIRECTED COMPOUNDS AND REAGENTS FOR PREPARATION THEREOF NEORX CORPORATION (US) 1996-06-13 WO disclosed
WO-1995015978-A1 PRETARGETING METHODS AND COMPOUNDS NEORX CORPORATION (US) 1995-06-15 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 (1 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-20030129191-A1 Pretargeting methods and compounds BTD, HLCS, STRA6 MAPT 2022/4885MEN1 496/4885KMT2A 4611/4885

“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.