SCHEMBL1318202

SCHEMBL1318202

NC(N)(N)C(CC(=O)O)(CC(=O)O)C(CC(=O)O)(CC(=O)O)CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
HMGCR P04035 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
ACLY P53396 3/20 0.33
CPT2 P23786 2/20 0.33
GLRA1 P23415 1/20 0.32
SLC6A9 P48067 1/20 0.32
OR51E2 Q9H255 1/20 0.32
FFAR1 O14842 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL6560588 0.73 KDM4E (0.33) ALDH1A1KDM4ECYP2D6TSHRCYP2C19
SCHEMBL670654 0.72 HIF1A (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL5691059 0.69 ALDH1A1 (0.41) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL26361 0.67 ALDH1A1 (0.45) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL10589741 0.67
SCHEMBL16374685 0.67 ALDH1A1 (0.45) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Ammonia Solution, Strong SCHEMBL10589727 0.67 ALDH1A1 (0.39) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL9771853 0.67 ALDH1A1 (0.40) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL7148379 0.67 ALDH1A1 (0.40) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL7148369 0.67 ALDH1A1 (0.40) ALDH1A1HMGCRCHRM1TBXA2RADRA1A

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-103293145-B Chemical luminous reagent 赫利森(厦门)生物科技有限公司 2016-08-10 CN disclosed
US-20160222379-A1 USE OF MULTIPLE RECOMBINATION SITES WITH UNIQUE SPECIFICITY IN COMBINATIONAL CLONING INVITROGEN CORPORATION 2016-08-04 US disclosed
US-20140296093-A1 USE OF MULTIPLE RECOMBINATION SITES WITH UNIQUE SPECIFICITY IN COMBINATIONAL CLONING Life Technologies Corporation (US) 2014-10-02 US disclosed
US-20140051843-A1 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSION PROTEINS Life Technologies Corporation (US) 2014-02-20 US disclosed
CN-103293145-A Chemical luminous reagent HELIOSENSE BIOTECHNOLOGIES INC 2013-09-11 CN disclosed
US-20120183999-A1 USE OF MULTIPLE RECOMBINATION SITES WITH UNIQUE SPECIFICITY IN COMBINATIONAL CLONING Life Technologies Corporation (US) 2012-07-19 US disclosed
US-20110275541-A1 USE OF MULTIPLE RECOMBINATION SITES WITH UNIQUE SPECIFICITY IN COMBINATIONAL CLONING INVITROGEN CORPORATION (US) 2011-11-10 US disclosed
US-20110269120-A1 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSIONPROTEINS Life Technologies Corporation (US) 2011-11-03 US disclosed
US-20090176975-A1 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSION PROTEINS INVITROGEN CORPORATION (US) 2009-07-09 US disclosed
US-7351578-B2 Use of multiple recombination sites with unique specificity in recombinational cloning INVITROGEN CORP. (US) 2008-04-01 US disclosed
EP-1644538-A4 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSION PROTEINS INVITROGEN CORP (US) 2006-11-08 EP disclosed
EP-1644538-A2 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSION PROTEINS INVITROGEN CORPORATION (US) 2006-04-12 EP disclosed
US-20050095615-A1 Methods and compositions for detecting promoter activity and expressing fusion proteins Life Technologies Corporation 2005-05-05 US disclosed
WO-2005028615-A2 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSION PROTEINS INVITROGEN CORPORATION (US) 2005-03-31 WO disclosed
US-20040229229-A1 Microarray comprising two or more immobilized vectors for use as replication and gene transfer tools; simultaneous cloning of two or more nucleotide sequences INVITROGEN CORPORATION 2004-11-18 US disclosed
US-20020192736-A1 Assay of peroxidase activity PIERCE CHEMICAL COMPANY 2002-12-19 US disclosed
EP-0898620-B1 ASSAY OF PEROXIDASE ACTIVITY PIERCE CHEMICAL CO (US) 2002-11-06 EP disclosed
US-6432662-B1 SOLUTION OF CHEMILUMINESCENT CYCLIC DIACYLHYDRAZIDE, AT LEAST ONE AZINE ENHANCER AND AT LEAST ONE OXIDIZING AGENT PIERCE CHEMICAL COMPANY 2002-08-13 US disclosed
EP-0898620-A1 ASSAY OF PEROXIDASE ACTIVITY PIERCE CHEMICAL COMPANY (US) 1999-03-03 EP disclosed
WO-1997039142-A1 ASSAY OF PEROXIDASE ACTIVITY PIERCE CHEMICAL COMPANY (US) 1997-10-23 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-20140051843-A1 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSION PROTEINS RNGTT, CPSF6, NUDT21 ALDH1A1 4182/4885HMGCR 4687/4885CHRM1 4840/4885
US-20110269120-A1 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSIONPROTEINS RNGTT, CPSF6, NUDT21 ALDH1A1 4075/4885HMGCR 4627/4885CHRM1 4829/4885
US-20090176975-A1 METHODS AND COMPOSITIONS FOR DETECTING PROMOTER ACTIVITY AND EXPRESSING FUSION PROTEINS RNGTT, CPSF6, NUDT21 ALDH1A1 4182/4885HMGCR 4687/4885CHRM1 4840/4885
US-20050095615-A1 Methods and compositions for detecting promoter activity and expressing fusion proteins RNGTT, CPSF6, NUDT21 ALDH1A1 4182/4885HMGCR 4687/4885CHRM1 4840/4885

“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.