SCHEMBL7779103

SCHEMBL7779103

CCCCCCC(CCC)C(C(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.55
FFAR1 O14842 2/20 0.55
MAPT P10636 1/20 0.53
LCK P06239 1/20 0.53
PPARD Q03181 1/20 0.53
ZDHHC20 Q5W0Z9 1/20 0.53
ZDHHC2 Q9UIJ5 1/20 0.53
ACE2 Q9BYF1 1/20 0.50
CA2 P00918 1/20 0.47
GRIK1 P39086 2/20 0.46
GRIK2 Q13002 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
ZDHHC7 Q9NXF8 1/20 0.44
CA1 P00915 1/20 0.44
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43

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
SCHEMBL28364272 1.00 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7204731 1.00 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL24106546 0.96 GPR84 (0.59) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28277568 0.96 GPR84 (0.59) GPR84FFAR1MAPTLCKPPARD
SCHEMBL6439326 0.96 GPR84 (0.59) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3213683 0.96 GPR84 (0.59) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8670606 0.92 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5860247 0.91 GPR84 (0.54) GPR84FFAR1MAPTLCKPPARD
SCHEMBL337303 0.88 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL338380 0.88 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6251946-B1 SATURATED OR UNSATURATED BRANCHED FATTY ACID CONTAINING LIPID ESTER OR FATTY ACID AMIDE TO TREAT CENTRAL NERVOUS SYSTEM DISORDERS, INCLUDING EPILEPSY, MIGRAINES, CHRONIC PAIN AND BIPOLAR DISORDERS D-PHARM LTD. (IL) 2001-06-26 US disclosed
EP-1009734-A1 BRANCHED CHAIN FATTY ACIDS, THEIR DERIVATIVES AND USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS D-PHARM, LTD. (IL) 2000-06-21 EP disclosed
WO-1999002485-A1 BRANCHED CHAIN FATTY ACIDS, THEIR DERIVATIVES AND USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS D-PHARM LTD. (IL) 1999-01-21 WO disclosed