SCHEMBL5437789

SCHEMBL5437789

C=CCCCC=CCOCCOC(=O)CCCCC(=O)OCCOCC=CCCCC=C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
LMNA P02545 2/20 0.44
EPHX2 P34913 1/20 0.42
TSHR P16473 4/20 0.41
DGKA P23743 2/20 0.40
MGLL Q99685 1/20 0.39
MAPT P10636 3/20 0.38
THRB P10828 1/20 0.38
CNR1 P21554 1/20 0.38
CYP3A4 P08684 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ABCC4 O15439 1/20 0.37
NR1I2 O75469 1/20 0.36
PGR P06401 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
PTGS2 P35354 1/20 0.36
PDE4D Q08499 1/20 0.36
USP2 O75604 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
SCHEMBL5436266 0.95 EPHX2 (0.38) ALDH1A1LMNAEPHX2TSHRDGKA
SCHEMBL5451678 0.90 MAPT (0.41) ALDH1A1LMNAEPHX2TSHRMGLL
SCHEMBL5443446 0.87 MAPT (0.37) ALDH1A1LMNAEPHX2TSHRMGLL
SCHEMBL5440233 0.84 ALDH1A1 (0.44) ALDH1A1LMNATSHRMAPTTHRB
SCHEMBL5440237 0.84 ALDH1A1 (0.44) ALDH1A1LMNATSHRMAPTTHRB
SCHEMBL5441923 0.84 ALDH1A1 (0.44) ALDH1A1LMNATSHRMAPTTHRB
SCHEMBL7256465 0.84 ALDH1A1 (0.54) ALDH1A1LMNAEPHX2TSHRDGKA
SCHEMBL5675420 0.84 ALDH1A1 (0.44) ALDH1A1LMNATSHRMAPTTHRB
SCHEMBL353661 0.83 TSHR (0.56) ALDH1A1LMNATSHRMAPTTHRB
SCHEMBL355562 0.83 TSHR (0.56) ALDH1A1LMNATSHRMAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070060713-A1 Reactive diluents in coating formulation BP CHEMICALS LIMITED (GB) 2007-03-15 US claimed
EP-1620515-B1 REACTIVE DILUENTS IN COATING FORMULATION UNIV SOUTHERN MISSISSIPPI RES (US) 2006-12-27 EP claimed
JP-2006525402-A 2006-11-09 JP claimed
EP-1620515-A1 REACTIVE DILUENTS IN COATING FORMULATION The University of Southern Mississippi Research Foundation (US) 2006-02-01 EP claimed
WO-2004099329-A1 REACTIVE DILUENTS IN COATING FORMULATION THE UNIVERSITY OF SOUTHERN MISSISSIPPI RESEARCH FOUNDATION (US) 2004-11-18 WO claimed
US-20070060713-A1 Reactive diluents in coating formulation BP CHEMICALS LIMITED (GB) 2007-03-15 US disclosed
EP-1620515-B1 REACTIVE DILUENTS IN COATING FORMULATION UNIV SOUTHERN MISSISSIPPI RES (US) 2006-12-27 EP disclosed
EP-1620515-A1 REACTIVE DILUENTS IN COATING FORMULATION The University of Southern Mississippi Research Foundation (US) 2006-02-01 EP disclosed
WO-2004099329-A1 REACTIVE DILUENTS IN COATING FORMULATION THE UNIVERSITY OF SOUTHERN MISSISSIPPI RESEARCH FOUNDATION (US) 2004-11-18 WO disclosed