SCHEMBL8230933

SCHEMBL8230933

CC(CCCCCCCCCCO)C(=O)O.CC(CCCCCCCCCCO)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.55
BLM P54132 1/20 0.54
LTA4H P09960 1/20 0.53
GABRR1 P24046 2/20 0.50
CYP1A2 P05177 1/20 0.50
TBXAS1 P24557 2/20 0.46
GPR84 Q9NQS5 4/20 0.42
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42
CA1 P00915 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL8984494 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL8984408 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL4451173 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL3685397 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL8984664 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL16536902 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL8984582 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL5074983 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL1875589 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2
SCHEMBL1875207 1.00 ACE2 (0.55) ACE2BLMLTA4HGABRR1CYP1A2

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-0991777-A1 NUCLEIC ACID BIOSENSOR DIAGNOSTICS Krull, Ulrich J. (CA) 2000-04-12 EP disclosed
WO-1998058079-A1 NUCLEIC ACID BIOSENSOR DIAGNOSTICS KRULL ULRICH J (CA) 1998-12-23 WO disclosed