SCHEMBL2037549

SCHEMBL2037549

C=C(C)C(=O)OCCC(COP(=O)(O)O)[N+](CCCC)(CCCC)CCCC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
ENPP2 Q13822 6/20 0.37
LPAR3 Q9UBY5 6/20 0.37
LPAR1 Q92633 5/20 0.37
LPAR5 Q9H1C0 2/20 0.37
LPAR6 P43657 1/20 0.37
LPAR4 Q99677 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
THRB P10828 1/20 0.36
SGPL1 O95470 4/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL28637235 0.93 TSHR (0.40) TSHRENPP2LPAR3LPAR1LPAR5
SCHEMBL28874092 0.91 TSHR (0.46) TSHRENPP2LPAR3LPAR1LPAR5
SCHEMBL541928 0.91 TSHR (0.43) TSHRTHRBSMN1; SMN2
SCHEMBL28874094 0.89 TSHR (0.43) TSHRENPP2LPAR3LPAR1LPAR5
SCHEMBL20582579 0.87 THRB (0.40) TSHRENPP2LPAR3LPAR1LPAR5
SCHEMBL2034320 0.87 TSHR (0.47) TSHRENPP2LPAR3LPAR1LPAR5
SCHEMBL2037326 0.84 TSHR (0.43) TSHRTHRB
SCHEMBL28874078 0.84 TSHR (0.41) TSHRLPAR3LPAR1LPAR2THRB
SCHEMBL28874076 0.83 TSHR (0.41) TSHRENPP2LPAR3LPAR1LPAR2
SCHEMBL541550 0.83 TSHR (0.38) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108463493-B Polymeric substrate having a surface with reduced biomolecule adhesion and thermoplastic articles of such substrate SIO2医药产品公司 2021-10-15 CN disclosed
CN-107249652-B Method for manufacturing medical device and medical device JSR株式会社 2021-01-12 CN disclosed
US-20200300847-A1 ADDITIVE, SURFACE TREATMENT AGENT, SURFACE-MODIFIED LATEX PARTICLES, METHOD FOR PRODUCING SURFACE-MODIFIED LATEX PARTICLES, REAGENT FOR LATEX AGGLUTINATION REACTION, KIT, AND METHOD FOR DETECTING TARGET SUBSTANCE JICC-02 CORPORATION (JP) 2020-09-24 US disclosed
EP-3415913-A1 ADDITIVE, SURFACE TREATMENT AGENT, SURFACE-MODIFIED LATEX PARTICLES, METHOD FOR PRODUCING SURFACE-MODIFIED LATEX PARTICLES, REAGENT FOR LATEX AGGLUTINATION REACTION, KIT, AND METHOD FOR DETECTING TARGET SUBSTANCE JSR Corporation (JP) 2018-12-19 EP disclosed
EP-2512416-A2 COSMETIC TREATMENT METHOD INVOLVING A COMPOUND CAPABLE OF CONDENSING IN SITU L'Oréal (FR) 2012-10-24 EP disclosed
WO-2011073279-A2 COSMETIC TREATMENT METHOD INVOLVING A COMPOUND CAPABLE OF CONDENSING IN SITU L'OREAL (FR) 2011-06-23 WO disclosed