Heneicosanoic Acid

Heneicosanoic Acid

SCHEMBL9762071

C=CC(=O)OCCO.CCCCCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.59

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.59
HPGD P15428 1/20 0.59
GPR84 Q9NQS5 7/20 0.53
PPARG P37231 7/20 0.53
PPARD Q03181 7/20 0.53
PPARA Q07869 7/20 0.53
HDAC11 Q96DB2 5/20 0.53
PTPN1 P18031 3/20 0.53
ALDH1A1 P00352 3/20 0.53
FABP4 P15090 3/20 0.53
TLR2 O60603 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALOX15 P16050 2/20 0.53
HSD17B10 Q99714 2/20 0.53
SLC22A6 Q4U2R8 1/20 0.53
SLC22A8 Q8TCC7 1/20 0.53
MEN1 O00255 1/20 0.53
ESR1 P03372 1/20 0.53
PDE4A P27815 1/20 0.53
KMT2A Q03164 1/20 0.53

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
Stearic Acid SCHEMBL28139957 0.90 TSHR (0.73) TSHRHPGDGPR84PPARGPPARD
Hexane SCHEMBL8110181 0.88 TSHR (0.76) TSHRHPGDALDH1A1HSD17B10MEN1
SCHEMBL8467131 0.87 TSHR (0.72) TSHRHPGDALDH1A1HSD17B10MEN1
1-Hexanol SCHEMBL28725970 0.87 TSHR (0.68) TSHRHPGDALDH1A1HSD17B10MEN1
SCHEMBL29285338 0.87 TSHR (0.72) TSHRHPGDALDH1A1HSD17B10MEN1
Stearic Acid SCHEMBL22712402 0.86 TSHR (0.57) TSHRHPGDGPR84PPARGPPARD
Palmitic Acid SCHEMBL21296046 0.86 TSHR (0.57) TSHRHPGDGPR84PPARGPPARD
SCHEMBL9443408 0.85 TSHR (0.76) TSHRHPGDALDH1A1HSD17B10MEN1
Succinic Acid SCHEMBL27826759 0.85 TSHR (0.70) TSHRHPGDGPR84PPARGPPARD
SCHEMBL8382799 0.85 TSHR (0.56) TSHRHPGDALDH1A1HSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5021530-A Cationic electrodepositable coatings KANSAI PAINT CO., LTD. (JP) 1991-06-04 US disclosed