SCHEMBL939237

SCHEMBL939237

CCCCCCCCc1ccccc1OP(=O)(O)OCCO

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
P2RY10 O00398 8/20 0.44
GPR34 Q9UPC5 5/20 0.44
GPR174 Q9BXC1 5/20 0.43
PPARA Q07869 2/20 0.43
LIPG Q9Y5X9 1/20 0.42
ALOX5 P09917 1/20 0.42
PTGS2 P35354 1/20 0.42
PPARG P37231 1/20 0.41
CETP P11597 2/20 0.40

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
SCHEMBL28150352 0.90 P2RY10 (0.50) THRATHRBP2RY10GPR34GPR174
SCHEMBL29389849 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL8814499 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL29721429 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL29799602 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL679570 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL2694356 0.86 THRA (0.45) THRATHRBP2RY10GPR34GPR174
SCHEMBL20139445 0.86 THRA (0.55) THRATHRBPPARALIPGALOX5
SCHEMBL1396938 0.86 THRA (0.55) THRATHRBPPARALIPGALOX5
SCHEMBL1396899 0.86 THRA (0.55) THRATHRBPPARALIPGALOX5

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-1996660-B1 INKJET INK COMPOSITION HEWLETT PACKARD DEVELOPMENT CO (US) 2010-01-06 EP claimed
US-7872060-B2 Inkjet ink composition HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2011-01-18 US disclosed
EP-1996660-B1 INKJET INK COMPOSITION HEWLETT PACKARD DEVELOPMENT CO (US) 2010-01-06 EP disclosed
EP-1996660-A2 INKJET INK COMPOSITION Hewlett-Packard Development Company, L.P. (US) 2008-12-03 EP disclosed
WO-2007112244-A2 INKJET INK COMPOSITION HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2007-10-04 WO disclosed
US-20070225400-A1 Inkjet ink composition HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2007-09-27 US disclosed