SCHEMBL8577154

SCHEMBL8577154

C=C(O)CC(O)CCCCC

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.61
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
NFKB1 P19838 1/20 0.42
FAAH O00519 2/20 0.40
TRPV1 Q8NER1 1/20 0.39
PSMD14 O00487 2/20 0.39
PLA2G1B P04054 2/20 0.39
MMP2 P08253 2/20 0.39
ATG4B Q9Y4P1 2/20 0.39
HSP90AA1 P07900 1/20 0.39
RAD52 P43351 1/20 0.39
SPHK1 Q9NYA1 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
SCHEMBL26667095 0.82 GPR84 (0.55) GPR84FFAR1FFAR4NFKB1TRPV1
SCHEMBL25501505 0.80 GPR84 (0.59) GPR84FFAR1FFAR4NFKB1PSMD14
SCHEMBL16976234 0.80 GPR84 (0.53) GPR84FFAR1FFAR4NFKB1TRPV1
SCHEMBL9014471 0.78 GPR84 (0.57) GPR84FFAR1FFAR4NFKB1PSMD14
SCHEMBL19115436 0.78 FFAR1 (0.66) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL16309039 0.78 FFAR1 (0.66) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL1067037 0.77 GPR84 (0.96) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL112858 0.77 GPR84 (0.96) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL6240298 0.77 GPR84 (0.96) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL30787358 0.77 FFAR1 (0.62) GPR84FFAR1FFAR4NFKB1FAAH

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839180-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITIONS INCLUDING CHELANTS THE PROCTER & GAMBLE COMPANY (US) 1998-05-06 EP disclosed
WO-1998017756-A1 CONCENTRATED FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-04-30 WO disclosed
WO-1998017750-A1 CONCENTRATED, FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-04-30 WO disclosed
WO-1997003172-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITIONS INCLUDING CHELANTS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO disclosed