SCHEMBL6466748

SCHEMBL6466748

C=C(CCCO)C(=O)O.CC(=CCCCO)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 1/20 0.34
SQLE Q14534 2/20 0.33
TBXAS1 P24557 3/20 0.33
CD81 P60033 1/20 0.32
PPARG P37231 1/20 0.31
EP300 Q09472 1/20 0.31
BACE1 P56817 1/20 0.30

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
SCHEMBL9066943 0.95 GPR84 (0.35) SQLETBXAS1CD81PPARGEP300
SCHEMBL9066939 0.95 GPR84 (0.35) SQLETBXAS1CD81PPARGEP300
SCHEMBL1648946 0.93 CAMK2A (0.34) CAMK2ASQLETBXAS1CD81PPARG
SCHEMBL9067031 0.90 CAMK2A (0.32) CAMK2ASQLETBXAS1CD81PPARG
SCHEMBL9067036 0.90 CAMK2A (0.32) CAMK2ASQLETBXAS1CD81PPARG
SCHEMBL1697278 0.89 CD81 (0.35) TBXAS1CD81PPARGEP300BACE1
SCHEMBL1651671 0.88 GPR84 (0.35) SQLETBXAS1CD81PPARG
SCHEMBL1651674 0.88 GPR84 (0.35) SQLETBXAS1CD81PPARG
SCHEMBL16666 0.85 EP300 (0.39) CAMK2ASQLETBXAS1CD81PPARG
SCHEMBL149851 0.85 EP300 (0.39) CAMK2ASQLETBXAS1CD81PPARG

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
EP-1443079-B1 Incorporation of a self-crosslinking polymer into a nonwoven binder for use in improving the wet strength of pre-moistened wipes AIR PRODUCTS POLYMERS LP (US) 2005-10-12 EP claimed