SCHEMBL11751086

SCHEMBL11751086

CCCCC[C@H](O)CCCC(Cl)(CCCCCCC(=O)O)C(C)=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 3/20 0.69
▸ FFAR1 O14842 3/20 0.69
▸ FAAH O00519 1/20 0.50
▸ TBXA2R P21731 1/20 0.49
▸ PTGFR P43088 1/20 0.49
▸ PTGER2 P43116 1/20 0.49
▸ GPR84 Q9NQS5 9/20 0.49
▸ PPARG P37231 6/20 0.49
▸ PPARD Q03181 6/20 0.49
▸ PPARA Q07869 6/20 0.49
▸ HDAC11 Q96DB2 5/20 0.49
▸ TSHR P16473 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ TLR2 O60603 2/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ FABP4 P15090 2/20 0.49
▸ PTPN1 P18031 2/20 0.49
▸ SLC22A6 Q4U2R8 1/20 0.49
▸ SLC22A8 Q8TCC7 1/20 0.49
▸ MEN1 O00255 1/20 0.49

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
SCHEMBL11749035 1.00 FFAR4 (0.69) FFAR4FFAR1FAAHTBXA2RPTGFR
SCHEMBL11750363 1.00 FFAR4 (0.69) FFAR4FFAR1FAAHTBXA2RPTGFR
SCHEMBL11752741 0.87 FFAR4 (0.50) FFAR4FFAR1FAAHTBXA2RPTGFR
SCHEMBL11745379 0.87 FFAR4 (0.49) FFAR4FFAR1FAAHTBXA2RPTGFR
SCHEMBL11749786 0.86 FFAR4 (0.47) FFAR4FFAR1TBXA2RPTGFRPTGER2
SCHEMBL11747867 0.85 L3MBTL1 (0.49) FFAR4FFAR1FAAHPTGER2GPR84
SCHEMBL22400946 0.84 FFAR4 (0.96) FFAR4FFAR1GPR84PPARGPPARD
SCHEMBL22400855 0.84 FFAR4 (0.96) FFAR4FFAR1GPR84PPARGPPARD
SCHEMBL17133174 0.84 FFAR4 (0.96) FFAR4FFAR1GPR84PPARGPPARD
SCHEMBL22400909 0.84 FFAR4 (0.96) FFAR4FFAR1GPR84PPARGPPARD

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
US-3991087-A RENAL VASODILATORS, HYPOTENSIVE AGENTS, ANTITHROMBOTICS MERCK & CO., INC. (US) 1976-11-09 — — US claimed
US-4059602-A HYPOTENSIVE, VASODILATION, ANTITHROMBOSIS MERCK & CO., INC. (US) 1977-11-22 — — US disclosed
US-4059601-A VASODILATION, HYPOTENSIVE, ANTITHROMBOSIS MERCK & CO., INC. (US) 1977-11-22 — — US disclosed
US-3991087-A RENAL VASODILATORS, HYPOTENSIVE AGENTS, ANTITHROMBOTICS MERCK & CO., INC. (US) 1976-11-09 — — US disclosed
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