SCHEMBL28028704

SCHEMBL28028704

CCCCCC(O)CCS(N)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.48
FFAR1 O14842 1/20 0.48
NFKB1 P19838 1/20 0.47
TP53 P04637 1/20 0.47
GPR84 Q9NQS5 6/20 0.46
CA2 P00918 4/20 0.44
CA1 P00915 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
FDPS P14324 1/20 0.41
FAAH O00519 1/20 0.40
PSMD14 O00487 2/20 0.40
PLA2G1B P04054 2/20 0.40
MMP2 P08253 2/20 0.40
ATG4B Q9Y4P1 2/20 0.40
HSP90AA1 P07900 1/20 0.40
RAD52 P43351 1/20 0.40

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
SCHEMBL10693142 0.82 FFAR1 (0.55) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL11761075 0.82 FFAR1 (0.50) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL11504371 0.80 FFAR1 (0.53) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL8168148 0.80 FFAR1 (0.53) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL11503963 0.80 FFAR1 (0.53) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL15754570 0.80 FFAR4 (0.48) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL11441152 0.80 FFAR1 (0.53) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL11503912 0.80 FFAR1 (0.53) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL11787584 0.80 FFAR1 (0.53) FFAR4FFAR1NFKB1TP53GPR84
SCHEMBL11503791 0.80 FFAR1 (0.53) FFAR4FFAR1NFKB1TP53GPR84

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
CN-104854093-A NOVEL SELECTIVE ANDROGEN RECEPTOR MODULATORS PFIZER 2015-08-19 CN disclosed