SCHEMBL6155458

SCHEMBL6155458

CC(C)(C)[Si](C)(C)OCc1cc(C=Cc2cccc(CCCCC(=O)O)c2)cc(CO[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
TBXAS1 P24557 7/20 0.38
AKR1B10 O60218 1/20 0.37
AKR1B1 P15121 1/20 0.37
ALOX5 P09917 1/20 0.37
PPARA Q07869 1/20 0.37
LTB4R Q15722 2/20 0.37
ALB P02768 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
HDAC3 O15379 1/20 0.36
MAPK1 P28482 1/20 0.36
ADRA1A P35348 1/20 0.36
HDAC4 P56524 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HDAC1 Q13547 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL6155454 1.00 MAPT (0.40) MAPTRXFP1CYSLTR2CYSLTR1TBXAS1
SCHEMBL6885100 0.90 CYP4F2 (0.44) AKR1B10AKR1B1ALOX5CYP4F2CYP4A11
SCHEMBL6156155 0.85 HMGCR (0.49) AKR1B10AKR1B1CYP4F2CYP4A11HDAC4
SCHEMBL20298754 0.78 LCK (0.44) MAPTPPARASMN1; SMN2BACE1
SCHEMBL8891538 0.74 APP (0.51) ALOX5HDAC4BACE1
SCHEMBL8891530 0.74 APP (0.51) ALOX5HDAC4BACE1
SCHEMBL6155460 0.74 MAPT (0.39) MAPTRXFP1CYSLTR2CYSLTR1TBXAS1
SCHEMBL6156487 0.73 CYSLTR2 (0.50) CYSLTR2CYSLTR1PPARACYP4F2CYP4A11
SCHEMBL6885569 0.73 FFAR1 (0.46) MAPTRXFP1TBXAS1
SCHEMBL4848823 0.73 MAPT (0.50) MAPTRXFP1CYSLTR2CYSLTR1TBXAS1

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