SCHEMBL14634772

SCHEMBL14634772

COC(=O)CC(O)C(=O)OC(=O)c1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.39
HPGD P15428 4/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 1/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.36
TNF P01375 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ABCB1 P08183 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL21952688 0.76 KMT2A (0.42) GAAHPGDMAPTALDH1A1KMT2A
SCHEMBL493370 0.73 KMT2A (0.45) GAAHPGDMAPTALDH1A1KMT2A
SCHEMBL5542753 0.72 KMT2A (0.53) GAAHPGDMAPTALDH1A1HSD17B10
SCHEMBL432792 0.72 KMT2A (0.52) GAAHPGDMAPTALDH1A1HSD17B10
SCHEMBL494453 0.70 LMNA (0.44) GAAHPGDMAPTALDH1A1HSD17B10
SCHEMBL27341918 0.69 TSHR (0.37) GAAALDH1A1HSD17B10KMT2AABCB1
SCHEMBL1691025 0.68 TSHR (0.43) GAAMAPTHSD17B10KMT2AABCB1
SCHEMBL1823637 0.68 TSHR (0.43) GAAMAPTHSD17B10KMT2AABCB1
SCHEMBL205700 0.68 TSHR (0.43) GAAMAPTHSD17B10KMT2AABCB1
SCHEMBL15362668 0.68 MAPT (0.36) GAAHPGDMAPTALDH1A1HSD17B10

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-7169774-B2 Cephalotaxane derivatives and their processes of preparation and purification STRAGEN PHARMA S.A. (CH) 2007-01-30 US disclosed