Decanoic Acid

Decanoic Acid

SCHEMBL5189249

CCCCCCCCCC(=O)O.Oc1c[nH]c2ccccc12

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.57
MAPT P10636 2/20 0.51
GABRA1 P14867 1/20 0.51
GABRB2 P47870 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
OXER1 Q8TDS5 1/20 0.51
ADAM17 P78536 1/20 0.50
NPC1 O15118 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 1/20 0.48
APAF1 O14727 1/20 0.48
POLB P06746 1/20 0.48
RECQL P46063 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PPARG P37231 6/20 0.47
PPARD Q03181 6/20 0.47
PPARA Q07869 6/20 0.47

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
Palmitic Acid SCHEMBL8441596 1.00 MTNR1A (0.57) MTNR1AMAPTGABRA1GABRB2CYP1A2
Myristic Acid SCHEMBL7796489 1.00 MTNR1A (0.57) MTNR1AMAPTGABRA1GABRB2CYP1A2
Dodecanoate SCHEMBL10609647 1.00 MTNR1A (0.57) MTNR1AMAPTGABRA1GABRB2CYP1A2
Stearic Acid SCHEMBL1863214 1.00 MTNR1A (0.57) MTNR1AMAPTGABRA1GABRB2CYP1A2
Octanoic Acid SCHEMBL4212535 1.00 MTNR1A (0.57) MTNR1AMAPTGABRA1GABRB2CYP1A2
Nonanoate SCHEMBL5185615 1.00 MTNR1A (0.57) MTNR1AMAPTGABRA1GABRB2CYP1A2
Octanoic Acid SCHEMBL4974971 0.99 MTNR1A (0.56) MTNR1AMAPTGABRA1GABRB2CYP1A2
Butyric Acid SCHEMBL1858948 0.90 ADAM17 (0.56) MTNR1AMAPTGABRA1GABRB2CYP1A2
Octanoic Acid SCHEMBL8441356 0.82 GSK3B (0.47) MTNR1AGABRA1GABRB2PPARGPPARD
Palmitic Acid SCHEMBL432580 0.82 GSK3B (0.47) OXER1PPARGPPARDPPARAGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160177370-A1 METHOD FOR DETECTING STREPTOCOCCUS AGALACTIAE USING ESTERASE ACTIVITY BIOMERIEUX SA (FR) 2016-06-23 US claimed
US-9309552-B2 Method for detecting Streptococcus agalactiae using esterase activity BIOMERIEUX (FR) 2016-04-12 US claimed
EP-2487235-B1 Medium for detecting Streptococcus agalatiae using esterase activity BIOMERIEUX SA (FR) 2014-07-02 EP claimed
EP-1789575-B1 METHOD FOR DETECTING STREPTOCOCCUS AGALACTIAE USING ESTERASE ACTIVITY BIOMERIEUX SA (FR) 2012-09-05 EP claimed
US-20160177370-A1 METHOD FOR DETECTING STREPTOCOCCUS AGALACTIAE USING ESTERASE ACTIVITY BIOMERIEUX SA (FR) 2016-06-23 US disclosed
US-9309552-B2 Method for detecting Streptococcus agalactiae using esterase activity BIOMERIEUX (FR) 2016-04-12 US disclosed
EP-2487235-B1 Medium for detecting Streptococcus agalatiae using esterase activity BIOMERIEUX SA (FR) 2014-07-02 EP disclosed
EP-1789575-B1 METHOD FOR DETECTING STREPTOCOCCUS AGALACTIAE USING ESTERASE ACTIVITY BIOMERIEUX SA (FR) 2012-09-05 EP disclosed
EP-2487235-A1 Medium for detecting streptococcus agalactiae using esterase activity bioMérieux (FR) 2012-08-15 EP disclosed
US-20070254326-A1 Method for Detecting Streptococcus Agalactiae Using Esterase Activity BIOMERIEUX (FR) 2007-11-01 US disclosed
EP-1789575-A2 METHOD FOR DETECTING STREPTOCOCCUS AGALACTIAE USING ESTERASE ACTIVITY BIOMERIEUX (FR) 2007-05-30 EP disclosed
WO-2006032809-A2 METHOD FOR DETECTING STREPTOCOCCUS AGALACTIAE USING ESTERASE ACTIVITY BIOMERIEUX (FR) 2006-03-30 WO disclosed