SCHEMBL3126715

SCHEMBL3126715

CC(=O)OCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
TSHR P16473 5/20 0.55
LMNA P02545 2/20 0.55
NFKB1 P19838 1/20 0.55
PMP22 Q01453 1/20 0.55
GPR84 Q9NQS5 8/20 0.50
PPARG P37231 7/20 0.50
PPARD Q03181 7/20 0.50
PPARA Q07869 7/20 0.50
HDAC11 Q96DB2 5/20 0.50
PTPN1 P18031 3/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
MEN1 O00255 1/20 0.50
ESR1 P03372 1/20 0.50
ALOX15 P16050 1/20 0.50
PDE4A P27815 1/20 0.50

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
SCHEMBL3503408 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
Octanedioate SCHEMBL30142541 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL7751954 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL3504185 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
Sebacic Acid SCHEMBL30142535 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL10599212 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL17766864 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL3504428 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL3504719 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22
SCHEMBL3503980 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNANFKB1PMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150191607-A1 Anti-fouling Paints and Coatings REACTIVE SURFACES, LTD (US) 2015-07-09 US disclosed
US-8283482-B2 Method for producing cross-coupling compound KAO CORPORATION (JP) 2012-10-09 US disclosed
US-20100210745-A1 Molecular Healing of Polymeric Materials, Coatings, Plastics, Elastomers, Composites, Laminates, Adhesives, and Sealants by Active Enzymes REACTIVE SURFACES, LTD. (US) 2010-08-19 US disclosed
US-20100048929-A1 METHOD FOR PRODUCING CROSS-COUPLING COMPOUND KAO CORPORATION (JP) 2010-02-25 US disclosed
EP-2143705-A1 METHOD FOR PRODUCING CROSS-COUPLING COMPOUND Kao Corporation (JP) 2010-01-13 EP disclosed
US-4246182-A Process for the preparation of omega-hydroxy fatty acids from omega-hydroxy (or acyloxy)-alkyl-γ-butyrolactones SODA KORYO KABUSHIKI KAISHA (JP) 1981-01-20 US disclosed
US-4244873-A Omega-hydroxy or acyloxy-alkyl-γ-butyrolactones SODA KORYO KABUSHIKI KAISHA (JP) 1981-01-13 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 (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-20100048929-A1 METHOD FOR PRODUCING CROSS-COUPLING COMPOUND FASN, ELOVL3, ELOVL1 ALDH1A1 1646/4885TSHR 1184/4885LMNA 437/4885

“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.