SCHEMBL10443233

SCHEMBL10443233

CCCCCCC(CCCCC)C(C(=O)O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.52
NAAA Q02083 2/20 0.48
GPR84 Q9NQS5 3/20 0.46
FFAR1 O14842 1/20 0.46
ASAH1 Q13510 2/20 0.46
ALDH1A1 P00352 2/20 0.44
ACER2 Q5QJU3 1/20 0.44
MAPT P10636 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
POLB P06746 1/20 0.44
CNR2 P34972 1/20 0.44
CYSLTR2 Q9NS75 1/20 0.43
CYSLTR1 Q9Y271 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CES2 O00748 1/20 0.42

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
SCHEMBL31447436 1.00 CYP2D6 (0.52) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL10443338 1.00 CYP2D6 (0.52) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL31447452 0.94 CYP2D6 (0.48) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL9069102 0.85 CSNK1E (0.51) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL27501974 0.85 ALDH1A1 (0.50) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL3447635 0.85 CSNK1E (0.51) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL9069104 0.85 CSNK1E (0.51) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL28393580 0.83 CYP2D6 (0.52) CYP2D6NAAAGPR84FFAR1ASAH1
SCHEMBL8695600 0.81 NAAA (0.43) NAAAASAH1ALDH1A1ACER2POLB
SCHEMBL30674033 0.81 NAAA (0.43) NAAAASAH1ALDH1A1ACER2POLB

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-0386243-A1 PLATINUM (II) COMPLEXES SAGAMI CHEMICAL RESEARCH CENTER (JP) 1990-09-12 EP disclosed