SCHEMBL6662367

SCHEMBL6662367

CC(O)C(O)CCCC(O)CCCCCO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.43
TRPA1 O75762 1/20 0.43
SPHK1 Q9NYA1 2/20 0.38
PTPN1 P18031 2/20 0.36
CYP2D6 P10635 2/20 0.35
LMNA P02545 2/20 0.35
GMNN O75496 1/20 0.35
POLB P06746 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
BLM P54132 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
CETP P11597 1/20 0.35
HTT P42858 1/20 0.35
UBE2N P61088 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL16074762 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL11410290 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074675 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074863 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074889 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074937 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074741 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074945 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074914 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6
SCHEMBL16074850 0.91 TRPV1 (0.50) TRPV1TRPA1SPHK1PTPN1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1482997-A1 AnB BLOCK COPOLYMERS CONTAINING POLY(VINYL PYRROLIDONE) UNITS, MEDICAL DEVICES, AND METHODS Medtronic, Inc. (US) 2004-12-08 EP disclosed
EP-1446437-A1 COMPOUNDS CONTAINING QUATERNARY CARBONS, MEDICAL DEVICES, AND METHODS Medtronic, Inc. (US) 2004-08-18 EP disclosed
WO-2003072158-A1 AnB BLOCK COPOLYMERS CONTAINING POLY(VINYL PYRROLIDONE) UNITS, MEDICAL DEVICES, AND METHODS MEDTRONIC,INC. (US) 2003-09-04 WO disclosed
WO-2003042273-A1 COMPOUNDS CONTAINING QUATERNARY CARBONS, MEDICAL DEVICES, AND METHODS MEDTRONIC, INC. (US) 2003-05-22 WO disclosed