Sugi Predict

Sugi Predict / Compounds / SCHEMBL6155136

SCHEMBL6155136

SCHEMBL6155136

CC(CCCC(C)(C)O)c1cccc(OCc2ccc(COC(C)(C)C(C)(C)C)c(C(C)(C)O[SiH2]C(C)(C)C)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 11/20 0.38
▸ CYSLTR2 Q9NS75 1/20 0.37
▸ CYSLTR1 Q9Y271 1/20 0.37
▸ ADAMTS4 O75173 1/20 0.32

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
SCHEMBL6155769 0.81 CYSLTR2 (0.35) FFAR1CYSLTR2CYSLTR1ADAMTS4
SCHEMBL6155133 0.79 CYSLTR2 (0.37) FFAR1CYSLTR2CYSLTR1
SCHEMBL6155131 0.77 CYSLTR2 (0.36) FFAR1CYSLTR2CYSLTR1ADAMTS4
SCHEMBL6155571 0.77 VDR (0.46) FFAR1CYSLTR2CYSLTR1
SCHEMBL2109172 0.75 VDR (0.41) FFAR1CYSLTR2CYSLTR1ADAMTS4
SCHEMBL6155242 0.74 VDR (0.44) FFAR1CYSLTR2CYSLTR1
SCHEMBL6155413 0.74 CYSLTR2 (0.47) FFAR1CYSLTR2CYSLTR1
SCHEMBL6154987 0.74 PTGER3 (0.34) FFAR1CYSLTR2CYSLTR1ADAMTS4
SCHEMBL6155587 0.73 CYSLTR2 (0.44) FFAR1CYSLTR2CYSLTR1
SCHEMBL6158473 0.72 CYP4F2 (0.38) FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 — — EP disclosed
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 — — EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 — — WO disclosed