SCHEMBL1157567

SCHEMBL1157567

Nc1c(C(=O)O)cccc1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.49
FABP7 O15540 2/20 0.49
KMT2A Q03164 2/20 0.47
EPHX2 P34913 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
G6PD P11413 1/20 0.41
CASP7 P55210 1/20 0.41
CASP6 P55212 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MYC P01106 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
CASP3 P42574 1/20 0.38

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
SCHEMBL30662743 1.00 FABP5 (0.49) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL3195566 0.87 FABP5 (0.47) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL3212375 0.86 FABP5 (0.46) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL3203817 0.86 EPHX2 (0.47) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL3209504 0.86 FABP5 (0.46) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL3199959 0.85 FABP5 (0.45) FABP5FABP7KMT2AEPHX2CA1
Acetic Acid SCHEMBL6859342 0.85 FABP5 (0.45) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL2946613 0.84 KMT2A (0.48) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL132407 0.84 FABP5 (0.47) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL3220033 0.84 FABP5 (0.48) FABP5FABP7KMT2AEPHX2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030050248-A1 Novel amino acid and peptide inhibitors of Staphylococcus virulence PANORAMA RESEARCH, INC. 2003-03-13 US claimed
EP-1261362-A2 NOVEL AMINO ACID AND PEPTIDE INHIBITORS OF STAPHYLOCOCCUS VIRULENCE Intermune, Inc. (US) 2002-12-04 EP claimed
WO-2001058471-A2 NOVEL AMINO ACID AND PEPTIDE INHIBITORS OF STAPHYLOCOCCUS VIRULENCE INTERMUNE, INC. (US) 2001-08-16 WO claimed
CN-118084813-A Macrocyclic compounds 诺和诺德牛津研究中心有限公司 2024-05-28 CN disclosed
CN-110691777-B Macrocyclic compounds 诺和诺德牛津研究中心有限公司 2024-03-01 CN disclosed
CN-110691777-A Macrocyclic compounds 兹洛有限公司 2020-01-14 CN disclosed
US-10131658-B2 Anti-alphavbeta1 integrin compounds and methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-11-20 US disclosed
US-20180312500-A9 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-11-01 US disclosed
US-9682123-B2 Methods of treating metabolic disease THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-06-20 US disclosed
US-20160376266-A1 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS UNIV CALIFORNIA (US) 2016-12-29 US disclosed
EP-3052515-A1 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS The Regents of the University of California (US) 2016-08-10 EP disclosed
US-20020048763-A1 Human genome-derived single exon nucleic acid probes useful for gene expression analysis AMERSHAM PLC (GB) 2002-04-25 US disclosed
WO-2002026818-A2 HUMAN NEDD-1 AEOMICA, INT. (US) 2002-04-04 WO disclosed
WO-2002024718-A1 COMPOSITIONS AND METHODS RELATING TO PROSTATE SPECIFIC GENES AND PROTEINS DIADEXUS, INC. (US) 2002-03-28 WO disclosed
WO-2002024750-A2 HUMAN KIDNEY TUMOR OVEREXPRESSED MEMBRANE PROTEIN 1 AEOMICA, INC. (US) 2002-03-28 WO disclosed
WO-2001092524-A2 MYOSIN-LIKE GENE EXPRESSED IN HUMAN HEART AND MUSCLE AEOMICA, INC. (US) 2001-12-06 WO disclosed
WO-2001058471-A2 NOVEL AMINO ACID AND PEPTIDE INHIBITORS OF STAPHYLOCOCCUS VIRULENCE INTERMUNE, INC. (US) 2001-08-16 WO disclosed
EP-0824538-A1 SACCHAROPEPTIDES AND DERIVATIVES THEREOF GLYCOMED INCORPORATED (US) 1998-02-25 EP disclosed
WO-1996035700-A9 SACCHAROPEPTIDES AND DERIVATIVES THEREOF 1997-02-13 WO disclosed
WO-1996035700-A1 SACCHAROPEPTIDES AND DERIVATIVES THEREOF GLYCOMED INCORPORATED (US) 1996-11-14 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 (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-20180312500-A9 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS ITGB1, ITGAV, ITGA1 FABP5 2562/4885FABP7 4048/4885KMT2A 3854/4885
US-10131658-B2 Anti-alphavbeta1 integrin compounds and methods ITGB1, ITGAV, ITGA1 FABP5 2562/4885FABP7 4048/4885KMT2A 3854/4885
US-20160376266-A1 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS ITGB1, ITGAV, ITGA1 FABP5 2562/4885FABP7 4048/4885KMT2A 3854/4885

“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.