SCHEMBL14101249

SCHEMBL14101249

CC1(C)CC(=O)C(O)=C1O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.35
GAA P10253 1/20 0.33
TYR P14679 1/20 0.31

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
SCHEMBL11029124 0.77 ALDH1A1 (0.35) ALDH1A1MAPTKDM4EPOLBGAA
SCHEMBL10454004 0.77 ALDH1A1 (0.35) ALDH1A1MAPTKDM4EPOLBGAA
SCHEMBL3154825 0.73 DUSP3 (0.34) ALDH1A1MAPTKDM4EPOLBGAA
SCHEMBL9073045 0.67 CYP19A1 (0.34) TYR
SCHEMBL5609353 0.67 ALDH1A1 (0.61) ALDH1A1MAPTKDM4EPOLBGAA
SCHEMBL14573652 0.66 ALDH1A1 (0.32) ALDH1A1MAPTPOLB
SCHEMBL6473109 0.65
SCHEMBL856999 0.65 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EPOLBGAA
SCHEMBL20269352 0.62 ALDH1A1 (0.31) ALDH1A1MAPTKDM4EPOLBTYR
SCHEMBL28885198 0.61 MAOA (0.36) ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7405744-B2 Thermal developing apparatus FUJFILM CORPORATION (JP) 2008-07-29 US disclosed