SCHEMBL2502759

SCHEMBL2502759

CCCCC[C](CC)C(C)CCCCC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.48
FFAR4 Q5NUL3 1/20 0.44
FFAR1 O14842 1/20 0.44
OPRM1 P35372 1/20 0.41
FDPS P14324 4/20 0.40
ACE2 Q9BYF1 1/20 0.39
SPHK1 Q9NYA1 1/20 0.39
FAAH O00519 1/20 0.39
NFKB1 P19838 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37

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
SCHEMBL3836960 0.91 FFAR4 (0.39) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL11670081 0.91 CA1 (0.52) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL16828369 0.89 CA1 (0.47) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL2486387 0.88 CA1 (0.50) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL4170211 0.88 CA1 (0.50) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL2482671 0.88 CA1 (0.50) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL11331130 0.88 CA1 (0.50) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL16096992 0.88 CA1 (0.50) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL2488264 0.88 CA1 (0.50) CA1FFAR4FFAR1OPRM1FDPS
SCHEMBL8106055 0.88 CA1 (0.50) CA1FFAR4FFAR1OPRM1FDPS

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-8729220-B2 Annellated dithiophene copolymers BASF SE (DE) 2014-05-20 US disclosed
US-20110240973-A1 Annellated Dithiophene Copolymers BASF SE (DE) 2011-10-06 US disclosed