SCHEMBL6575633

SCHEMBL6575633

CCCCCCCCCCCCCCCCC(C)CC(O)CCCCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.50
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
ACE2 Q9BYF1 1/20 0.48
SPHK1 Q9NYA1 1/20 0.48
PSMD14 O00487 2/20 0.43
PLA2G1B P04054 2/20 0.43
MMP2 P08253 2/20 0.43
ATG4B Q9Y4P1 2/20 0.43
HSP90AA1 P07900 1/20 0.43
RAD52 P43351 1/20 0.43
LMNA P02545 1/20 0.43
NFKB1 P19838 1/20 0.42
FAAH O00519 1/20 0.42
OPRM1 P35372 1/20 0.41

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
SCHEMBL4760260 1.00 GPR84 (0.50) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL9583241 1.00 GPR84 (0.50) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL6768549 1.00 GPR84 (0.50) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL28662727 0.98 GPR84 (0.48) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL28665092 0.98 GPR84 (0.48) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL13483768 0.98 GPR84 (0.48) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL13483767 0.98 GPR84 (0.48) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL23517200 0.98 GPR84 (0.47) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL20677244 0.93 GPR84 (0.48) GPR84FFAR1FFAR4ACE2SPHK1
SCHEMBL13483766 0.93 ACE2 (0.47) GPR84FFAR1FFAR4ACE2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0936256-B1 Phase change ink formulation using urethane isocyanate-derived resins XEROX CORP (US) 2004-05-19 EP disclosed
EP-0936257-B1 Phase change ink formulation using urethane isocyanate-derived resins and a toughening agent XEROX CORP (US) 2004-05-06 EP disclosed
EP-1024157-A1 Urethane isocyanate-derived resins for use in a phase change ink formulation TEKTRONIX, INC. (US) 2000-08-02 EP disclosed
EP-0936257-A1 Phase change ink formulation using urethane isocyanate-derived resins and a toughening agent Tektronic Inc (US) 1999-08-18 EP disclosed
EP-0936256-A1 Phase change ink formulation using urethane isocyanate-derived resins Tektronic Inc (US) 1999-08-18 EP disclosed