Sugi Predict

Sugi Predict / Compounds / SCHEMBL27557366

SCHEMBL27557366

SCHEMBL27557366

CC(C)(O)CCCCCc1ccc(CCc2ccc(CO)c(O)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 5/20 0.47
▸ IGF1R P08069 6/20 0.43
▸ ALOX15 P16050 6/20 0.43
▸ ACHE P22303 2/20 0.43
▸ PPARA Q07869 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ CYP19A1 P11511 1/20 0.38
▸ ESR2 Q92731 1/20 0.38

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
SCHEMBL6155280 0.89 KLF10 (0.44) BCHEIGF1RALOX15
SCHEMBL6154950 0.87 KLF10 (0.45) IGF1RALOX15
SCHEMBL6154891 0.84 HMGCR (0.39) BCHEIGF1RALOX15PPARAESR1
SCHEMBL6154895 0.84 HMGCR (0.39) BCHEIGF1RALOX15PPARAESR1
SCHEMBL6884197 0.83 ALOX15 (0.63) IGF1RALOX15
SCHEMBL6155935 0.82 IGF1R (0.41) BCHEIGF1RALOX15
SCHEMBL30379508 0.80 BCHE (0.46) BCHEIGF1RALOX15ACHEESR1
SCHEMBL28999119 0.80 BCHE (0.46) BCHEIGF1RALOX15ACHEESR1
SCHEMBL9768519 0.79 PPARA (0.58) BCHEIGF1RALOX15ACHEPPARA
SCHEMBL6155863 0.78 MMP2 (0.42) BCHEIGF1RALOX15

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
CN-1282636-C Vitamin D analogues GALDERMA RES & DEV (FR) 2006-11-01 — — CN disclosed
CN-1332711-A Vitamin D analogues GALDERMA RES & DEV (FR) 2002-01-23 — — CN disclosed