SCHEMBL27645451

SCHEMBL27645451

CC(C)(CO)C(N)C(=O)O.CCCCCCCCCCCCCCCCC(O)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.64
FFAR1 O14842 2/20 0.64
GRIK1 P39086 2/20 0.46
GRIK2 Q13002 2/20 0.46
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
MAPT P10636 2/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
CYP2D6 P10635 2/20 0.40
SPHK1 Q9NYA1 1/20 0.40
GMNN O75496 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
THPO P40225 1/20 0.40
MTOR P42345 1/20 0.40
BLM P54132 1/20 0.40
KDM4E B2RXH2 1/20 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
SCHEMBL27343418 0.94 GPR84 (0.53) GPR84FFAR1GRIK1GRIK2SLC1A2
SCHEMBL27362313 0.88 GPR84 (0.44) GPR84FFAR1GRIK1GRIK2SLC1A2
SCHEMBL27308404 0.87 GPR84 (0.43) GPR84FFAR1GRIK1GRIK2SLC1A2
SCHEMBL27357032 0.83 TET2 (0.44) GPR84FFAR1GRIK1GRIK2SLC1A2
SCHEMBL27363392 0.82 GPR84 (0.40) GPR84FFAR1MAPT
SCHEMBL8772485 0.82 GPR84 (0.81) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL8772473 0.82 GPR84 (0.81) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL9579859 0.82 GPR84 (0.81) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL29853894 0.82 GPR84 (0.81) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL27497065 0.80 PTGS1 (0.41) GPR84FFAR1SLC1A2SLC1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101914124-B Nucleoside phosphonate conjugates as anti HIV agents GILEAD SCIENCES INC 2012-07-18 CN disclosed
CN-1780643-B Antiviral phosphonate analogs GILEAD SCIENCES INC 2012-04-25 CN disclosed
CN-101935333-A Nucleoside phosphonate conjugates as anti-hiv agent GILEAD SCIENCES INC 2011-01-05 CN disclosed
CN-101914124-A Nucleoside phosphonate conjugates as anti-hiv agent GILEAD SCIENCES INC 2010-12-15 CN disclosed
CN-101031306-B Nucleoside phosphonate conjugates as anti-HIV agents GILEAD SCIENCES INC 2010-09-22 CN disclosed
CN-101591281-A Phosphonate compounds having immunomodulatory activity GILEAD SCIENCES INC (US) 2009-12-02 CN disclosed
CN-101410120-A Anti-inflammatory phosphonate compounds GILEAD SCIENCES INC (US) 2009-04-15 CN disclosed
CN-101381379-A Kinase inhibitor phosphonate conjugates GILEAD SCIENCES INC (US) 2009-03-11 CN disclosed
CN-101031306-A Nucleoside phosphonate conjugates as anti-HIV agents GILEAD SCIENCES INC (US) 2007-09-05 CN disclosed
CN-101027062-A Phosphonate analogs of HIV inhibitor compounds GILEAD SCIENCES INC (US) 2007-08-29 CN disclosed
CN-101027312-A Antiviral compounds GILEAD SCIENCES INC (US) 2007-08-29 CN disclosed
CN-1933844-A Phosphonate compounds having immuno-modulatory activity GILEAD SCIENCES INC (US) 2007-03-21 CN disclosed
CN-1819832-A Kinase inhibitory phosphonate analogs GILEAD SCIENCES INC (US) 2006-08-16 CN disclosed
CN-1780643-A Antiviral phosphonate analogs GILEAD SCIENCES INC (US) 2006-05-31 CN disclosed
CN-1780631-A anticancer phosphonate analogs GILEAD SCIENCES INC (US) 2006-05-31 CN disclosed
CN-1780630-A Phosphonate compounds having immunomodulatory activity GILEAD SCIENCES INC (US) 2006-05-31 CN disclosed