SCHEMBL2865050

SCHEMBL2865050

CC(=O)c1occ(O)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
THRB P10828 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 3/20 0.33
CREBBP Q92793 1/20 0.33
KDM4E B2RXH2 3/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NSD2 O96028 1/20 0.31
MCL1 Q07820 1/20 0.31
FFAR1 O14842 1/20 0.31
CA5A P35218 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL1940732 0.79 KDM4E (0.34) MEN1KMT2ATHRBCYP3A4HPGD
SCHEMBL11074175 0.74 KDM4E (0.31) KDM4EALDH1A1LMNA
SCHEMBL5370780 0.72
SCHEMBL11376880 0.71 CYP3A4 (0.40) MEN1KMT2ATHRBCYP3A4HPGD
SCHEMBL10349890 0.69 ALDH1A1 (0.48) MEN1KMT2AHPGDMAPTPOLB
SCHEMBL25332706 0.67 KDM4E (0.55) THRBMAPTKDM4EALDH1A1LMNA
SCHEMBL6855931 0.67 NQO1 (0.31)
SCHEMBL27812 0.67
SCHEMBL1666652 0.65 ALDH1A1 (0.36) MEN1KMT2ATHRBCYP3A4HPGD
SCHEMBL909634 0.64

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-2611800-B1 METHODS AND SYSTEMS FOR PROCESSING SUGAR MIXTURES AND RESULTANT COMPOSITIONS VIRDIA INC (US) 2019-06-12 EP claimed
WO-2010068054-A3 METHOD FOR PREPARING BIOALCOHOL INGREDIENT HAVING LOW CONCENTRATION OF TOXIC MATERIALS FROM RED ALGAE AND METHOD FOR PRODUCING BIOALCOHOL THROUGH THE SAME (주)페가서스인터내셔날 (KR) 2010-09-10 WO disclosed
WO-2010068054-A2 METHOD FOR PREPARING BIOALCOHOL INGREDIENT HAVING LOW CONCENTRATION OF TOXIC MATERIALS FROM RED ALGAE AND METHOD FOR PRODUCING BIOALCOHOL THROUGH THE SAME (주)페가서스인터내셔날 (KR) 2010-06-17 WO disclosed