SCHEMBL11615130

SCHEMBL11615130

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

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.57
▸ FFAR1 O14842 2/20 0.57
▸ KDM4C Q9H3R0 2/20 0.50
▸ KDM4A O75164 1/20 0.50
▸ PHF8 Q9UPP1 1/20 0.50
▸ KDM2A Q9Y2K7 1/20 0.50
▸ ACACB O00763 1/20 0.41
▸ ACACA Q13085 1/20 0.41
▸ FAAH O00519 2/20 0.41
▸ TBXA2R P21731 1/20 0.41
▸ PTGFR P43088 1/20 0.41
▸ PTGER2 P43116 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ BLM P54132 1/20 0.40

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
SCHEMBL11615881 0.87 FFAR4 (0.77) FFAR4FFAR1FAAHALDH1A1
SCHEMBL11618654 0.87 FFAR4 (0.77) FFAR4FFAR1FAAHALDH1A1
SCHEMBL7550732 0.87 FFAR4 (0.77) FFAR4FFAR1FAAHALDH1A1
SCHEMBL11615905 0.87 FFAR4 (0.77) FFAR4FFAR1FAAHALDH1A1
SCHEMBL11743888 0.86 FFAR4 (0.56) FFAR4FFAR1KDM4CKDM4APHF8
SCHEMBL11615802 0.86 FFAR4 (0.56) FFAR4FFAR1ACACBACACAFAAH
SCHEMBL11613594 0.85 FFAR4 (0.69) FFAR4FFAR1FAAHTBXA2RPTGFR
SCHEMBL11617329 0.85 FFAR4 (0.74) FFAR4FFAR1FAAHALDH1A1
SCHEMBL11659103 0.84 FFAR4 (0.46) FFAR4FFAR1KDM4CKDM4APHF8
SCHEMBL11619689 0.83 FFAR4 (0.75) FFAR4FFAR1FAAHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4097504-A 11,12-Secoprostaglandins MERCK & CO., INC. (US) 1978-06-27 — — US disclosed
US-4092356-A 11,12-Secoprostaglandins MERCK & CO., INC. (US) 1978-05-30 — — US disclosed
US-4066692-A 11,12-SECOPROSTAGLANDINS MERCK & CO., INC. (US) 1978-01-03 — — US disclosed
US-4059601-A VASODILATION, HYPOTENSIVE, ANTITHROMBOSIS MERCK & CO., INC. (US) 1977-11-22 — — US disclosed
US-4059602-A HYPOTENSIVE, VASODILATION, 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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