SCHEMBL27634765

SCHEMBL27634765

CCc1c(OCOC)ccc(C(=O)c2ccccc2)c1CCOC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.43
MAPK1 P28482 3/20 0.43
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 2/20 0.43
ALOX15 P16050 2/20 0.43
LMNA P02545 6/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CLCN2 P51788 1/20 0.39
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
RAB9A P51151 1/20 0.37
EGFR P00533 1/20 0.37
HPGD P15428 3/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 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
SCHEMBL15225636 0.86 ABCB1 (0.43) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL27634759 0.85 MAPT (0.43) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL6032170 0.85 MAPT (0.43) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL4324522 0.84 MAPT (0.45) MAPTMAPK1KDM4EHTTSMN1; SMN2
SCHEMBL2857509 0.83 EGFR (0.39) MAPTMAPK1KDM4EHSD17B10LMNA
SCHEMBL21483094 0.74 PPARG (0.57) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL30070784 0.74 PPARG (0.57) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL30070813 0.74 ELANE (0.54) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL2065476 0.74 ELANE (0.54) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL2865657 0.74 EGFR (0.40) MAPTMAPK1KDM4EHSD17B10LMNA

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-100567242-C Hsp90 family protein blockers KYOWA HAKKO KOGYO KK (JP) 2009-12-09 CN disclosed
CN-1791568-A Hsp90 family protein inhibitors KYOWA HAKKO KOGYO KK (JP) 2006-06-21 CN disclosed