SCHEMBL20746347

SCHEMBL20746347

CCCCCC(CCCCC)C(CC)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.50
CA2 P00918 2/20 0.50
GPR84 Q9NQS5 6/20 0.41
FFAR1 O14842 1/20 0.41
EPHX1 P07099 1/20 0.40
LAP3 P28838 2/20 0.39
MAPT P10636 1/20 0.39
TP53 P04637 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
GRIK1 P39086 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
GRIK2 Q13002 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
SCHEMBL17474425 0.94 CA2 (0.46) CA1CA2GPR84FFAR1EPHX1
SCHEMBL20610328 0.94 CA1 (0.48) CA1CA2GPR84FFAR1EPHX1
SCHEMBL28957130 0.92 CA2 (0.47) CA1CA2GPR84FFAR1EPHX1
SCHEMBL30679515 0.88 GPR84 (0.45) CA1CA2GPR84FFAR1EPHX1
SCHEMBL9676581 0.84 CA1 (0.47) CA1CA2GPR84FFAR1EPHX1
SCHEMBL7828210 0.82 CA2 (0.46) CA1CA2GPR84FFAR1EPHX1
SCHEMBL30403487 0.82 CA1 (0.48) CA1CA2GPR84FFAR1EPHX1
SCHEMBL7521928 0.81 SOAT1 (0.50) GPR84FFAR1TP53PPARD
SCHEMBL15329288 0.80 MAPT (0.54) CA1CA2GPR84FFAR1EPHX1
SCHEMBL83321 0.80 CA1 (0.42) CA1CA2GPR84FFAR1EPHX1

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
WO-2019036658-A1 COMPOSITIONS COMPRISING NON-HALOGENATED SOLVENTS FOR USE IN OIL AND/OR GAS WELLS AND RELATED METHODS FLOTEK- CHEMISTRY, LLC (US) 2019-02-21 WO disclosed
WO-2019036665-A1 COMPOSITIONS COMPRISING AROMATIC ESTER SOLVENTS FOR USE IN OIL AND/OR GAS WELLS AND RELATED METHODS FLOTEK CHEMISTRY, LLC (US) 2019-02-21 WO disclosed