SCHEMBL825651

SCHEMBL825651

O=C(O)CCCCCCCCCC(SSC(CCCCCCCCCC(=O)O)N1C(=O)CCC1=O)N1C(=O)CCC1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
GSTK1 Q9Y2Q3 2/20 0.39
PTGER4 P35408 7/20 0.38
PTGER3 P43115 6/20 0.38
PTGER2 P43116 5/20 0.38
FFAR4 Q5NUL3 1/20 0.38
FFAR1 O14842 1/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
PTGS1 P23219 4/20 0.37
PTGS2 P35354 4/20 0.37
ALDH1A1 P00352 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
SCHEMBL826505 1.00 LMNA (0.39) LMNATSHRNFKB1PMP22GSTK1
SCHEMBL4302806 1.00 LMNA (0.39) LMNATSHRNFKB1PMP22GSTK1
SCHEMBL4310967 0.98 GSTK1 (0.37) LMNATSHRNFKB1PMP22GSTK1
SCHEMBL846234 0.79 ALDH1A1 (0.47) LMNATSHRNFKB1PMP22GSTK1
SCHEMBL17821007 0.79 ALDH1A1 (0.47) LMNATSHRNFKB1PMP22GSTK1
SCHEMBL30773222 0.77 ALDH1A1 (0.49) LMNATSHRNFKB1PMP22GSTK1
SCHEMBL9607 0.75 KMT2A (0.43) KMT2AALDH1A1
Octanedioate SCHEMBL7080168 0.73 TSHR (0.55) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL15475975 0.72 PTGS1 (0.45) LMNAGSTK1PTGER4PTGER3PTGER2
SCHEMBL16460504 0.72 ALDH1A1 (0.35) LMNATSHRNFKB1PMP22GSTK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120135891-A1 METHODS AND DEVICES FOR EARLY DETECTION OF CANCER CELLS AND TYPES THROUGH MICROMECHANICAL INTERACTIONS STIHARU, ION 2012-05-31 US claimed
US-20080318242-A1 METHODS AND DEVICES FOR EARLY DETECTION OF CANCER CELLS AND TYPES THROUGH MICROMECHANICAL INTERACTIONS STIHARU, ION (CA) 2008-12-25 US claimed
US-7270954-B1 Hybridization of target DNA with immobilized nucleic acid analogs IRIS BIOTECHNOLOGIES, INC. (US) 2007-09-18 US claimed
US-20190285576-A1 SEMICONDUCTOR SENSOR, METHOD FOR PRODUCING THE SAME, AND COMBINED SENSOR TORAY INDUSTRIES, INC. (JP) 2019-09-19 US disclosed
EP-3531131-A1 SEMICONDUCTOR SENSOR AND MANUFACTURING METHOD FOR SAME, AND COMPOUND SENSOR Toray Industries, Inc. (JP) 2019-08-28 EP disclosed
US-20120135891-A1 METHODS AND DEVICES FOR EARLY DETECTION OF CANCER CELLS AND TYPES THROUGH MICROMECHANICAL INTERACTIONS STIHARU, ION 2012-05-31 US disclosed
US-8142720-B2 Molecules suitable for binding to a metal layer for covalently immobilizing biomolecules IMEC (BE) 2012-03-27 US disclosed
US-20110086779-A1 ARRAYS OF PROTEIN CAPTURE AGENTS AND METHODS OF USE THEREOF ZYOMYX, INC. (US) 2011-04-14 US disclosed
US-20110070661-A1 RAMAN-ACTIVE REAGENTS AND THE USE THEREOF IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2011-03-24 US disclosed
US-20110070662-A1 RAMAN-ACTIVE REAGENTS AND THE USE THEREOF IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2011-03-24 US disclosed
US-20100284860-A1 MOLECULES SUITABLE FOR BINDING TO A METAL LAYER FOR COVALENTLY IMMOBILIZING BIOMOLECULES IMEC (BE) 2010-11-11 US disclosed
US-6329209-B1 APPARATUS FOR ASSESSING PATTERNS OF PROTEIN EXPRESSION AND MODIFICATION IN CELLS; HAS SPACED-APART IMMOBILIZATION AREAS AND SURROUNDING BORDER AREAS WHICH RESIST NON-SPECIFIC PROTEIN BINDING ZYOMYX, INCORPORATED 2001-12-11 US disclosed
EP-1097379-A2 MICRODEVICES FOR SCREENING BIOMOLECULES Zyomyx, Inc. (US) 2001-05-09 EP disclosed
EP-1097377-A2 ARRAYS OF PROTEIN-CAPTURE AGENTS AND METHODS OF USE THEREOF Zyomyx, Inc. (US) 2001-05-09 EP disclosed
EP-1097380-A1 ARRAYS OF PROTEINS AND METHODS OF USE THEREOF Zyomyx, Inc. (US) 2001-05-09 EP disclosed
WO-2001001144-A2 HYBRIDIZATION OF TARGET DNA WITH IMMOBILIZED NUCLEIC ACID ANALOGS IRIS BIO TECHNOLOGIES (US) 2001-01-04 WO disclosed
WO-2000070345-A1 REVERSIBLE IMMOBILIZATION OF LIGANDS ONTO METAL SURFACES, THEIR PREPARATION AND USE IN BIOCHEMICAL APPLICATIONS IRIS BIO TECHNOLOGIES (US) 2000-11-23 WO disclosed
WO-2000004390-A2 MICRODEVICES FOR SCREENING BIOMOLECULES ZYOMYX, INC. (US) 2000-01-27 WO disclosed
WO-2000004389-A2 ARRAYS OF PROTEIN-CAPTURE AGENTS AND METHODS OF USE THEREOF ZYOMYX, INC. (US) 2000-01-27 WO disclosed
WO-2000004382-A1 ARRAYS OF PROTEINS AND METHODS OF USE THEREOF ZYOMYX, INC. (US) 2000-01-27 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-20100284860-A1 MOLECULES SUITABLE FOR BINDING TO A METAL LAYER FOR COVALENTLY IMMOBILIZING BIOMOLECULES EBPL, SPR, MB LMNA 2675/4885TSHR 1902/4885NFKB1 3208/4885

“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.