SCHEMBL722576

SCHEMBL722576

O=C(O)C(O)C(O)(CO)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACLY P53396 4/20 0.64
CPT2 P23786 1/20 0.64
OR51E2 Q9H255 1/20 0.36
HSPD1 P10809 1/20 0.32
BLM P54132 1/20 0.32
HSPE1 P61604 1/20 0.32
TSHR P16473 2/20 0.30
CYP2C9 P11712 1/20 0.30
PDE4A P27815 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
SCHEMBL29482688 1.00 ACLY (0.64) ACLYCPT2OR51E2HSPD1BLM
SCHEMBL22173716 0.81 CPT2 (0.43) ACLYCPT2TSHRCYP2C9
SCHEMBL9558578 0.79 ACLY (0.57) ACLYCPT2OR51E2PDE4A
SCHEMBL31390775 0.78 ACLY (0.61) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL2110910 0.78 ACLY (1.00) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL2111332 0.78 ACLY (1.00) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL17181773 0.78 ACLY (1.00) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL17181757 0.78 ACLY (1.00) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL6773065 0.78 ACLY (1.00) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL721435 0.78 ACLY (1.00) ACLYCPT2HSPD1BLMHSPE1

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
US-20120048295-A1 CLEANING FORMULATION FOR REMOVING RESIDUES ON SURFACES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2012-03-01 US disclosed
WO-2010104816-A1 CLEANING FORMULATION FOR REMOVING RESIDUES ON SURFACES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2010-09-16 WO disclosed