SCHEMBL11786145

SCHEMBL11786145

CC(=O)N(CCCCCCC(=O)O)CCCC(O)CCCC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.47
▸ FFAR1 O14842 2/20 0.47
▸ ACACB O00763 1/20 0.41
▸ ACACA Q13085 1/20 0.41
▸ KDM4C Q9H3R0 7/20 0.36
▸ KDM4A O75164 6/20 0.36
▸ PHF8 Q9UPP1 2/20 0.36
▸ KDM2A Q9Y2K7 2/20 0.36
▸ TBXA2R P21731 1/20 0.35
▸ PTGFR P43088 1/20 0.35
▸ PTGER2 P43116 1/20 0.35
▸ KDM5A P29375 1/20 0.35
▸ KDM7A Q6ZMT4 1/20 0.35
▸ FAAH O00519 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ PMP22 Q01453 1/20 0.34

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
SCHEMBL11795156 0.87 FFAR4 (0.46) FFAR4FFAR1ACACBACACAKDM4C
SCHEMBL11787985 0.85 FFAR4 (0.48) FFAR4FFAR1ACACBACACAKDM4C
SCHEMBL11783701 0.84 FFAR4 (0.71) FFAR4FFAR1TBXA2RPTGFRPTGER2
SCHEMBL11783707 0.84 FFAR4 (0.71) FFAR4FFAR1TBXA2RPTGFRPTGER2
SCHEMBL11783712 0.84 FFAR4 (0.71) FFAR4FFAR1TBXA2RPTGFRPTGER2
SCHEMBL11784174 0.84 FFAR4 (0.71) FFAR4FFAR1TBXA2RPTGFRPTGER2
SCHEMBL11786835 0.84 KDM4C (0.50) FFAR4FFAR1KDM4CKDM4APHF8
SCHEMBL11601969 0.82 FFAR4 (0.46) FFAR4FFAR1ACACBACACAKDM4C
SCHEMBL11792462 0.81 FFAR4 (0.45) FFAR4FFAR1ACACBACACAKDM4C
SCHEMBL11786566 0.81 MAPT (0.50) FFAR4FFAR1LMNA

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
US-3987091-A RENAL VASODILATORS MERCK & CO., INC. (US) 1976-10-19 — — US disclosed
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