SCHEMBL11742346

SCHEMBL11742346

NC(=O)C(CCCCCCC(=O)O)CCCC(O)CCCCC(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.47
▸ FFAR1 O14842 2/20 0.47
▸ ACACB O00763 1/20 0.44
▸ ACACA Q13085 1/20 0.44
▸ ALOX5 P09917 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.36
▸ PTPN1 P18031 1/20 0.35
▸ TBXA2R P21731 1/20 0.35
▸ PTGFR P43088 1/20 0.35
▸ PTGER2 P43116 1/20 0.35
▸ GSTK1 Q9Y2Q3 1/20 0.35
▸ ENPEP Q07075 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
SCHEMBL11620649 0.86 FFAR4 (0.51) FFAR4FFAR1ACACBACACAALOX5
SCHEMBL11744959 0.85 FFAR4 (0.54) FFAR4FFAR1ACACBACACAALDH1A1
SCHEMBL11743888 0.81 FFAR4 (0.56) FFAR4FFAR1ACACBACACAALDH1A1
SCHEMBL11743577 0.81 FFAR4 (0.75) FFAR4FFAR1ALDH1A1PTPN1FAAH
SCHEMBL11743880 0.81 FFAR4 (0.75) FFAR4FFAR1ALDH1A1PTPN1FAAH
SCHEMBL11743581 0.81 FFAR4 (0.75) FFAR4FFAR1ALDH1A1PTPN1FAAH
SCHEMBL11743835 0.81 FFAR4 (0.75) FFAR4FFAR1ALDH1A1PTPN1FAAH
SCHEMBL11746247 0.80 FFAR4 (0.51) FFAR4FFAR1ACACBACACAALOX5
SCHEMBL11792952 0.80 FFAR4 (0.44) FFAR4FFAR1ACACBACACAALOX5
SCHEMBL11516521 0.79 FFAR4 (0.50) FFAR4FFAR1ACACBACACAALOX5

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-4055597-A RENAL VASODILATORS MERCK & CO., INC. (US) 1977-10-25 — — US claimed
US-4055597-A RENAL VASODILATORS MERCK & CO., INC. (US) 1977-10-25 — — US disclosed
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