SCHEMBL3652249

SCHEMBL3652249

CC/[C]=C/CCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
THRB P10828 1/20 0.42
FAAH O00519 2/20 0.41
TRPV1 Q8NER1 2/20 0.41
DNM1 Q05193 3/20 0.39
EP300 Q09472 1/20 0.37
DUSP3 P51452 1/20 0.36
PTPN7 P35236 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL949869 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL7182170 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL7188921 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL7189741 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL489872 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL7175478 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL951294 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL7175480 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL951295 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL949871 1.00 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2136768-B1 STRUCTURED SURFACTANT COMPOSITIONS SOLVAY USA INC (US) 2018-10-17 EP disclosed
US-9090861-B2 Structured soap compositions RHODIA ASIA PACIFIC LTD. (SG) 2015-07-28 US disclosed
US-8828364-B2 Structured surfactant compositions RHODIA OPERATIONS (FR) 2014-09-09 US disclosed
EP-2179022-A2 STRUCTURED SOAP COMPOSITIONS Rodia Asia Pacific PTE, Limited (SG) 2010-04-28 EP disclosed
EP-2136768-A1 STRUCTURED SURFACTANT COMPOSITIONS Rhodia, Inc. (US) 2009-12-30 EP disclosed
WO-2009060312-A2 STRUCTURED SOAP COMPOSITIONS RHODIA ASIA PACIFIC PTE, LIMITED (SG) 2009-05-14 WO disclosed
US-20090048139-A1 Structured soap compositions RHODIA ASIA PACIFIC PTE, LIMITED (SG) 2009-02-19 US disclosed
WO-2008118381-A1 STRUCTURED SURFACTANT COMPOSITIONS RHODIA INC. (US) 2008-10-02 WO disclosed
US-20080233061-A1 Alkyl ether sulfate surfactant, alkyl sulfate surfactant, alkanolamide surfactant,amphoteric surfactant, and electrolyte; opacity, yield strength; sodium trideceth sulfate, sodium lauryl sulfate, ammonium lauryl sulfate, sodium lauroamphoacetate, coco monoethanolamide, ammonium chloride, citric acid SPECIALTY OPERATIONS FRANCE (FR) 2008-09-25 US disclosed
EP-0938842-B1 Sustained release pheromone dispenser SHINETSU CHEMICAL CO (JP) 2003-10-15 EP disclosed
US-6355236-B2 Sustained release pheromone formation SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-03-12 US disclosed
US-20010053372-A1 SUSTAINED RELEASE PHEROMONE FORMATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-12-20 US disclosed
EP-0938842-A1 Sustained release pheromone dispenser SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-09-01 EP disclosed
EP-0740651-A1 AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME Kao Corporation (JP) 1996-11-06 EP disclosed
WO-1995016664-A1 AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME KAO CORPORATION (JP) 1995-06-22 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-20080233061-A1 Alkyl ether sulfate surfactant, alkyl sulfate surfactant, alkanolamide surfactant,amphoteric surfactant, and electrolyte; opacity, yield strength; sodium trideceth sulfate, sodium lauryl sulfate, ammonium lauryl sulfate, sodium lauroamphoacetate, coco monoethanolamide, ammonium chloride, citric acid SGMS2, SGMS1, ACMSD TSHR 3693/4885THRB 4150/4885FAAH 53/4885

“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.