SCHEMBL9385488

SCHEMBL9385488

CCCCC(O)CCC(O)CCC(O)CCC(O)CCO

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.46
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.43
ALDH1A1 P00352 3/20 0.43
PSMD14 O00487 2/20 0.42
PLA2G1B P04054 2/20 0.42
MMP2 P08253 2/20 0.42
ATG4B Q9Y4P1 2/20 0.42
HSP90AA1 P07900 1/20 0.42
RAD52 P43351 1/20 0.42
NFKB1 P19838 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
FDPS P14324 1/20 0.41
GPR84 Q9NQS5 5/20 0.41
LMNA P02545 3/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 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
SCHEMBL3248913 0.97
SCHEMBL427481 0.97
SCHEMBL3250197 0.97
SCHEMBL27930888 0.95 THRB (0.46) THRBFFAR4FFAR1ALDH1A1PSMD14
Isopropyl Alcohol SCHEMBL8723907 0.92 THRB (0.43) THRBFFAR4FFAR1ALDH1A1PSMD14
SCHEMBL9051922 0.90 FFAR4 (0.55) FFAR4FFAR1ALDH1A1PSMD14PLA2G1B
SCHEMBL28349975 0.90 FFAR4 (0.55) FFAR4FFAR1ALDH1A1PSMD14PLA2G1B
SCHEMBL9051192 0.90 FFAR4 (0.55) FFAR4FFAR1ALDH1A1PSMD14PLA2G1B
SCHEMBL20896984 0.90 FFAR4 (0.55) FFAR4FFAR1ALDH1A1PSMD14PLA2G1B
SCHEMBL5414027 0.90 FFAR4 (0.54) THRBFFAR4FFAR1ALDH1A1PSMD14

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
WO-1994002540-A1 HIGHLY FILLED POLYMERIC COMPOSITIONS LUCEY MICHAEL F (US) 1994-02-03 WO disclosed