SCHEMBL3249371

SCHEMBL3249371

C=C(CC(CC)CCCC)C(=O)O.C=CCC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
CA2 P00918 3/20 0.38
ALDH1A1 P00352 4/20 0.37
TDP1 Q9NUW8 2/20 0.36
CYP3A4 P08684 2/20 0.36
ATM Q13315 1/20 0.36
MAPK1 P28482 1/20 0.35
RECQL P46063 1/20 0.33
GPR84 Q9NQS5 4/20 0.33
TET2 Q6N021 3/20 0.33
TET3 O43151 1/20 0.33
TET1 Q8NFU7 1/20 0.33

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
SCHEMBL15767897 0.95 TSHR (0.40) TSHRCA2ALDH1A1TDP1CYP3A4
Acrylonitrile SCHEMBL3260480 0.92 TSHR (0.38) TSHRCA2ALDH1A1TDP1CYP3A4
SCHEMBL22081 0.87 CA2 (0.47) TSHRCA2ALDH1A1TDP1CYP3A4
SCHEMBL20609791 0.87 CA2 (0.47) TSHRCA2ALDH1A1TDP1CYP3A4
SCHEMBL9281566 0.87 TSHR (0.42) TSHRCA2ALDH1A1TDP1CYP3A4
Acrylic Acid SCHEMBL4419560 0.86 TSHR (0.50) TSHRCA2ALDH1A1TDP1CYP3A4
Vinyl Chloride SCHEMBL10826111 0.86 TSHR (0.46) TSHRCA2ALDH1A1TDP1CYP3A4
Ethylene SCHEMBL1759446 0.86 CA2 (0.46) TSHRCA2ALDH1A1TDP1CYP3A4
SCHEMBL2275748 0.83 TSHR (0.40) TSHRCA2ALDH1A1TDP1CYP3A4
Methacrylic Acid SCHEMBL9065134 0.83 CA2 (0.43) TSHRCA2ALDH1A1TDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957549-B1 POLYVINYLESTER SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER CHEMIE AG (DE) 2010-05-19 EP claimed
EP-1957549-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY Wacker Polymer Systems GmbH & Co. KG (DE) 2008-08-20 EP claimed
WO-2007065804-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) 2007-06-14 WO claimed
EP-1957549-B1 POLYVINYLESTER SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER CHEMIE AG (DE) 2010-05-19 EP disclosed
EP-1957549-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY Wacker Polymer Systems GmbH & Co. KG (DE) 2008-08-20 EP disclosed
WO-2007065804-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) 2007-06-14 WO disclosed
EP-1713522-A1 WOUND DRESSING AND RAPID WOUND DRESSING COMPRISING A VASOCONSTRICTIVE INGREDIENT LTS LOHMANN Therapie-Systeme AG (DE) 2006-10-25 EP disclosed
WO-2005065732-A1 WOUND DRESSING AND RAPID WOUND DRESSING COMPRISING A VASOCONSTRICTIVE INGREDIENT LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2005-07-21 WO disclosed