SCHEMBL9629673

SCHEMBL9629673

CCCCCCCCCCC(O)COCCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.64
FFAR1 O14842 3/20 0.64
GPR84 Q9NQS5 8/20 0.56
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C19 P33261 1/20 0.54
PLA2G2C Q5R387 1/20 0.51
USP2 O75604 1/20 0.50
FAAH O00519 1/20 0.49
HTT P42858 1/20 0.49
PPARG P37231 4/20 0.47
PPARD Q03181 4/20 0.47
PPARA Q07869 4/20 0.47
TSHR P16473 3/20 0.47
HDAC11 Q96DB2 3/20 0.47
ALDH1A1 P00352 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
SLC22A6 Q4U2R8 1/20 0.47
SLC22A8 Q8TCC7 1/20 0.47
TLR2 O60603 1/20 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
SCHEMBL9628877 1.00 FFAR4 (0.64) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL9629137 1.00 FFAR4 (0.64) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL9629705 0.93 FFAR4 (0.53) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL9630851 0.92 FFAR4 (0.67) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL28747247 0.92 FFAR4 (0.67) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL9628887 0.92 FFAR4 (0.67) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL9629085 0.90 FFAR4 (0.70) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL9628902 0.88 USP2 (0.61) FFAR4FFAR1GPR84CYP1A2CYP3A4
SCHEMBL9629974 0.88 USP2 (0.61) FFAR4FFAR1GPR84CYP1A2CYP3A4
Myristic Acid SCHEMBL9615278 0.88 FFAR4 (0.66) FFAR4FFAR1GPR84PPARGPPARD

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
EP-0302007-B1 HYDROXYETHER-CARBOXYLIC ACIDS AND LACTONES THEREOF, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS CORROSION INHIBITORS CIBA-GEIGY AG (CH) 1992-05-13 EP disclosed
US-5055230-A Coating a metal surface with an aqueous system CIBA-GEIGY CORPORATION (US) 1991-10-08 US disclosed
EP-0302007-A1 Hydroxyether-carboxylic acids and lactones thereof, process for their production and their use as corrosion inhibitors CIBA-GEIGY AG (CH) 1989-02-01 EP disclosed