SCHEMBL2695646

SCHEMBL2695646

C=C(CCC(C)CCCCCCCCCCC)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.58
FFAR1 O14842 2/20 0.44
FFAR4 Q5NUL3 1/20 0.44
GPR84 Q9NQS5 9/20 0.44
MAPT P10636 2/20 0.44
PPARD Q03181 4/20 0.43
LCK P06239 1/20 0.43
ZDHHC20 Q5W0Z9 1/20 0.43
ZDHHC2 Q9UIJ5 1/20 0.43
THRB P10828 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
PGGT1B P53609 1/20 0.42
PPARG P37231 3/20 0.41
PPARA Q07869 3/20 0.41
TSHR P16473 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SLC22A6 Q4U2R8 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
SCHEMBL243679 1.00 ACE2 (0.58) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL12474726 1.00 ACE2 (0.58) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL3284960 1.00 ACE2 (0.58) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL16442960 1.00 ACE2 (0.58) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL1720748 1.00 ACE2 (0.58) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL289584 1.00 ACE2 (0.58) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL3280815 1.00 ACE2 (0.58) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL3289423 0.98 ACE2 (0.55) ACE2FFAR1FFAR4GPR84MAPT
SCHEMBL245039 0.93 ACE2 (0.58) ACE2FFAR1FFAR4GPR84PPARD
SCHEMBL245365 0.93 ACE2 (0.58) ACE2FFAR1FFAR4GPR84PPARD

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-2454351-B1 LUBRICATING COMPOSITION SHELL INT RESEARCH (NL) 2016-07-20 EP disclosed
US-9222053-B2 Lubricating composition SHELL OIL COMPANY (US) 2015-12-29 US disclosed
US-20150045272-A1 GREASE COMPOSITION SHELL OIL COMPANY 2015-02-12 US disclosed
US-20120142568-A1 LUBRICATING COMPOSITION SHELL OIL COMPANY 2012-06-07 US disclosed
US-20120108481-A1 LUBRICATING COMPOSITION SHELL OIL COMPANY 2012-05-03 US disclosed