SCHEMBL308732

SCHEMBL308732

NC(=O)c1cccc(CCCBr)c1C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HMGB1 P09429 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
BID P55957 4/20 0.36
MCL1 Q07820 4/20 0.36
BCL2L1 Q07817 3/20 0.36
BAK1 Q16611 3/20 0.36
KAT8 Q9H7Z6 2/20 0.36
FOLH1 Q04609 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
EP300 Q09472 1/20 0.36
KAT2A Q92830 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
SCHEMBL2778138 0.95 BID (0.38) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL28453652 0.94 BID (0.40) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL28457170 0.94 BID (0.40) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL3483399 0.90 KDM4E (0.38) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL8654059 0.83 HMGB1 (0.42) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL6565772 0.83 BID (0.49) MEN1KMT2AKDM4EMAPTHSD17B10
SCHEMBL6567329 0.82 HMGB1 (0.41) KDM4EMAPTHSD17B10HMGB1BID
SCHEMBL8654089 0.82 HMGB1 (0.41) KDM4EMAPTHSD17B10HMGB1BID
SCHEMBL6566933 0.82 BID (0.55) MEN1KMT2AKDM4EMAPTHSD17B10
SCHEMBL8654374 0.82 HMGB1 (0.41) KDM4EMAPTHSD17B10HMGB1BID

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105899503-B Selective GRP94 inhibitors and uses thereof 纪念斯隆-凯特琳癌症中心 2020-08-18 CN disclosed
US-20120122760-A1 NOVEL LIPIDS FOR TRANSFECTION OF NUCLEIC ACIDS THOMPSON, PATRICK R. 2012-05-17 US disclosed
US-8092661-B2 Electropolymerisable monomers, soluble in an aqueous solution and comprising a metalloporphyrin BIOMERIEUX (FR) 2012-01-10 US disclosed
US-8034977-B2 Lipids for transfection of nucleic acids MOLECULAR TRANSFER, INC. (US) 2011-10-11 US disclosed
US-7687070-B2 Reagents for intracellular delivery of macromolecules Life Technologies Corporation (US) 2010-03-30 US disclosed
US-20090314660-A1 Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin BIOMERIEUX (FR) 2009-12-24 US disclosed
US-7585970-B2 Method of polynucleotide synthesis using modified support AGILENT TECHNOLOGIES, INC. (US) 2009-09-08 US disclosed
US-20090215067-A1 NOVEL LIPIDS FOR TRANSFECTION OF NUCLEIC ACIDS MOLECULAR TRANSFER, INC. (US) 2009-08-27 US disclosed
US-7531693-B2 Lipids for transfection of nucleic acids MOLECULAR TRANSFER, INC. (US) 2009-05-12 US disclosed
US-7417139-B2 Method for polynucleotide synthesis AGILENT TECHNOLOGIES, INC. (US) 2008-08-26 US disclosed
EP-1628647-A4 NOVEL LIPIDS FOR TRANSFECTION OF NUCLEIC ACIDS MOLECULAR TRANSFER INC (US) 2007-10-24 EP disclosed
EP-1628647-A2 NOVEL LIPIDS FOR TRANSFECTION OF NUCLEIC ACIDS Molecular Transfer, Inc. (US) 2006-03-01 EP disclosed
US-6989434-B1 Reagents for intracellular delivery of macromolecules INVITROGEN CORPORATION (US) 2006-01-24 US disclosed
US-20050260757-A1 Novel reagents for intracellular delivery of macromolecules INVITROGEN COROPORATION (US) 2005-11-24 US disclosed
US-20050048496-A1 Method of polynucleotide synthesis using modified support AGILENT TECHNOLOGIES, INC. 2005-03-03 US disclosed
US-20050048601-A1 Method for polynucleotide synthesis REGENTS OF THE UNIVERSITY OF COLORADO, THE 2005-03-03 US disclosed
EP-1510522-A1 Method of polynucleotide synthesis using modified support Agilent Technologies Inc (US) 2005-03-02 EP disclosed
US-20050014962-A1 Novel lipids for transfection of nucleic acids THOMPSON AND PATRICIA A THOMPSON AS TRUSTEES OF THE THOMPSON FAMILY TRUST DATED AUGUST 27 2002, JOHN D. 2005-01-20 US disclosed
WO-2004105697-A2 NOVEL LIPIDS FOR TRANSFECTION OF NUCLEIC ACIDS MOLECULAR TRANSFER, INC. (US) 2004-12-09 WO disclosed
US-6075012-A TRANSFECTION LIFE TECHNOLOGIES, INC. (US) 2000-06-13 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 (7 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-20050048496-A1 Method of polynucleotide synthesis using modified support POLN, POLRMT, POLM MEN1 3171/4885KMT2A 2545/4885KDM4E 3869/4885
US-20050260757-A1 Novel reagents for intracellular delivery of macromolecules NPC1L1, CETP, LIPA MEN1 1702/4885KMT2A 3537/4885KDM4E 3854/4885
US-20050014962-A1 Novel lipids for transfection of nucleic acids ABHD16A, MBOAT7, NPC1L1 MEN1 2648/4885KMT2A 3361/4885KDM4E 4549/4885
US-20050048601-A1 Method for polynucleotide synthesis POLN, RNGTT, NSUN2 MEN1 3402/4885KMT2A 1288/4885KDM4E 2927/4885
US-20090215067-A1 NOVEL LIPIDS FOR TRANSFECTION OF NUCLEIC ACIDS ABHD16A, MBOAT7, NPC1L1 MEN1 2648/4885KMT2A 3361/4885KDM4E 4549/4885
US-20090314660-A1 Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin EPS15, PPOX, ACR MEN1 536/4885KMT2A 4151/4885KDM4E 3844/4885
US-20120122760-A1 NOVEL LIPIDS FOR TRANSFECTION OF NUCLEIC ACIDS ABHD16A, MBOAT7, NPC1L1 MEN1 2648/4885KMT2A 3361/4885KDM4E 4549/4885

“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.