SCHEMBL6213397

SCHEMBL6213397

COOC(=O)CCCCC(=O)OO

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
LMNA P02545 4/20 0.36
ALDH1A1 P00352 2/20 0.36
DGKA P23743 1/20 0.35
RECQL P46063 1/20 0.35
NAAA Q02083 2/20 0.33
PAM P19021 2/20 0.32
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 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
SCHEMBL6295113 0.98 TSHR (0.42) TSHRLMNAALDH1A1DGKARECQL
SCHEMBL6295981 0.98 TSHR (0.42) TSHRLMNAALDH1A1DGKARECQL
SCHEMBL5611206 0.95 TSHR (0.50) TSHRLMNAALDH1A1DGKARECQL
SCHEMBL3300140 0.90 TSHR (0.46) TSHRLMNAALDH1A1MAPTKMT2A
SCHEMBL20384143 0.87 TSHR (0.50) TSHRLMNAALDH1A1DGKARECQL
SCHEMBL133484 0.82 TSHR (0.45) TSHRLMNAALDH1A1DGKARECQL
SCHEMBL3446330 0.81 TSHR (0.60) TSHRLMNAALDH1A1KMT2A
SCHEMBL447628 0.81 DGKA (0.56) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL23232000 0.79 DGKA (0.59) TSHRLMNAALDH1A1DGKAPAM
SCHEMBL3446838 0.79 TSHR (0.58) TSHRLMNAALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1349912-B1 USE OF LOW FOAM PERCARBOXLIC ACID BASED PRODUCTS CONTAINING SURFACTANTS FOR CIP-DESINFECTION ECOLAB INC (US) 2005-03-02 EP claimed
US-6964787-B2 Method and system for reducing microbial burden on a food product ECOLAB INC. (US) 2005-11-15 US disclosed
US-6927237-B2 Two solvent antimicrobial compositions and methods employing them ECOLAB INC. (US) 2005-08-09 US disclosed
US-20050096245-A1 Two solvent antimicrobial compositions and methods employing them ECOLAB INC. (US) 2005-05-05 US disclosed
EP-1349912-B1 USE OF LOW FOAM PERCARBOXLIC ACID BASED PRODUCTS CONTAINING SURFACTANTS FOR CIP-DESINFECTION ECOLAB INC (US) 2005-03-02 EP disclosed
EP-1313515-A2 METHODS AND AGENTS FOR CLEANING AND DISINFECTING FRAGILE MEDICAL APPLIANCES Ecolab GmbH & CO. OHG (DE) 2003-05-28 EP disclosed
US-20020192340-A1 Method and system for reducing microbial burden on a food product ECOLAB USA INC. 2002-12-19 US disclosed
US-20020168422-A1 Two solvent antimicrobial compositions and methods employing them ECOLAB USA INC. 2002-11-14 US disclosed
WO-2002060280-A2 METHOD AND SYSTEM FOR REDUCING MICROBIAL BURDEN ON A FOOD PRODUCT BY APPLICATION OF ANTIMICROBIAL AGENT AND IRRADIATION TO THE FOOD PRODUCT ECOLAB INC. (US) 2002-08-08 WO disclosed
WO-2001047565-A2 METHODS AND AGENTS FOR CLEANING AND DISINFECTING FRAGILE MEDICAL APPLIANCES ECOLAB GMBH & CO. OHG (DE) 2001-07-05 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-20020168422-A1 Two solvent antimicrobial compositions and methods employing them TAS2R50, HDHD5, CEL TSHR 4520/4885LMNA 3815/4885ALDH1A1 2741/4885

“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.