SCHEMBL3755305

SCHEMBL3755305

C=C(C)C(=O)OC.CC=C(C)C(=O)O.CCCCCCCCCCCCC=CC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.47
TSHR P16473 2/20 0.40
PPARG P37231 4/20 0.40
PPARA Q07869 4/20 0.40
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
TERT O14746 3/20 0.38
MAPT P10636 2/20 0.38
BLM P54132 2/20 0.38
HSD17B10 Q99714 2/20 0.38
FABP4 P15090 2/20 0.38
PPARD Q03181 2/20 0.38
GMNN O75496 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL523379 0.95 ALDH1A1 (0.41) PTPN1TSHRPPARGPPARAFNTA
SCHEMBL15881925 0.92 PTPN1 (0.54) PTPN1TSHRPPARGPPARAALDH1A1
2-Undecylenic Acid SCHEMBL8535276 0.92 PTPN1 (0.54) PTPN1TSHRPPARGPPARAALDH1A1
SCHEMBL5833555 0.86 TSHR (0.37) PTPN1TSHRALDH1A1MAPT
SCHEMBL679802 0.86 ALDH1A1 (0.48) PTPN1TSHRPPARGPPARAALDH1A1
Methacrylic Acid SCHEMBL7949433 0.83 PTPN1 (0.45) PTPN1PPARGPPARAFNTAFNTB
SCHEMBL8943417 0.81 EP300 (0.49) TSHRFNTAFNTBALDH1A1MAPT
SCHEMBL11368184 0.81 ALDH1A1 (0.47) PTPN1TSHRPPARGPPARAALDH1A1
SCHEMBL31036754 0.81 EP300 (0.49) TSHRFNTAFNTBALDH1A1MAPT
SCHEMBL6519004 0.80 PTPN1 (0.50) PTPN1PPARGPPARAFNTAFNTB

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
EP-2708247-B1 IMPLANTABLE OR INSERTABLE MEDICAL DEVICES BOSTON SCIENT NEUROMODULATION CORP (US) 2017-06-14 EP disclosed
US-9220811-B2 Implantable or insertable medical devices BOSTON SCIENTIFIC SCIMED, INC. (US) 2015-12-29 US disclosed
EP-2711031-A2 Implantable or Insertable Medical Devices Boston Scientific Neuromodulation Corporation (US) 2014-03-26 EP disclosed
EP-2708247-A1 Implantable or Insertable Medical Devices Boston Scientific Neuromodulation Corporation (US) 2014-03-19 EP disclosed
EP-2344207-B1 IMPLANTABLE OR INSERTABLE MEDICAL DEVICES BOSTON SCIENT NEUROMODULATION (US) 2013-12-25 EP disclosed
US-20100256720-A1 IMPLANTABLE OR INSERTABLE MEDICAL DEVICES BOSTON SCIENTIFIC NEUROMODULATION CORPORATION (US) 2010-10-07 US disclosed