Arundic Acid

Arundic Acid

SCHEMBL5010028

CC(C)c1ccccc1/C=C/C(=O)O.CCCCCCC(CCC)C(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.41
CYSLTR1 Q9Y271 2/20 0.41
KDM4E B2RXH2 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
NFKB1 P19838 1/20 0.38
CA4 P22748 1/20 0.38
GRIK1 P39086 1/20 0.37
GRIK2 Q13002 1/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC2 Q92769 2/20 0.37
CHRM1 P11229 1/20 0.37
AKR1A1 P14550 1/20 0.37
CHRM3 P20309 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37
DRD3 P35462 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL28048305 0.83 CYSLTR2 (0.46) CYSLTR2CYSLTR1KDM4ECA1CA2
SCHEMBL28414685 0.79 CA1 (0.56) KDM4ECA1CA2NFKB1CA4
SCHEMBL819054 0.79 CA1 (0.56) KDM4ECA1CA2NFKB1CA4
SCHEMBL1958100 0.78 CYSLTR2 (0.43) CYSLTR2CYSLTR1KDM4ECA1CA2
SCHEMBL83533 0.77 SLC37A4 (0.47) CYSLTR2CYSLTR1KDM4ECA1CA2
SCHEMBL6851902 0.77 CA1 (0.47) CYSLTR2CYSLTR1KDM4ECA1CA2
SCHEMBL1082121 0.72 HTT (0.50) KDM4ECA1CA2NFKB1CA4
SCHEMBL1115939 0.71 CHRM1 (0.73) CA2GRIK1GRIK2HDAC1HDAC2
SCHEMBL432094 0.71 CHRM1 (0.73) CA2GRIK1GRIK2HDAC1HDAC2
SCHEMBL15499898 0.71 CHRM1 (0.73) CA2GRIK1GRIK2HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1922398-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-05-21 EP disclosed
WO-2007028477-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed