SCHEMBL1538030

SCHEMBL1538030

CCOC(=O)C1(C)COC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.43
BRD4 O60885 1/20 0.41
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 2/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX15 P16050 2/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
SOAT1 P35610 1/20 0.36
RECQL P46063 1/20 0.35
EPHX1 P07099 1/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
Water SCHEMBL1537978 0.98 ATM (0.42) ATMBRD4ALDH1A1TSHRPOLB
SCHEMBL19088338 0.92 ATM (0.41) ATMBRD4ALDH1A1TSHRPOLB
SCHEMBL26830530 0.85 ATM (0.42) ATMBRD4ALDH1A1TSHRPOLB
SCHEMBL25299400 0.84 ATM (0.39) ATMBRD4ALDH1A1TSHRPOLB
SCHEMBL11996073 0.84 ATM (0.36) ATMBRD4ALDH1A1TSHRPOLB
SCHEMBL28179054 0.83 ATM (0.41) ATMBRD4ALDH1A1TSHRPOLB
SCHEMBL2289941 0.81
SCHEMBL663919 0.80 ATM (0.50) ATMBRD4ALDH1A1TSHRPOLB
SCHEMBL6736700 0.79 POLB (0.46) ATMBRD4ALDH1A1POLBLMNA
SCHEMBL15543674 0.79 TSHR (0.44) ATMBRD4ALDH1A1TSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784441-B1 A HIGH LOADING FUNCTIONAL RESIN NOVO NORDISK AS (DK) 2011-03-09 EP disclosed
US-20080319097-A1 Polyether Polymer Matrix VERSAMATRIX A/S (DK) 2008-12-25 US disclosed
EP-1784441-A1 A HIGH LOADING FUNCTIONAL RESIN VersaMatrix A/S (DK) 2007-05-16 EP disclosed
WO-2006021217-A1 A HIGH LOADING FUNCTIONAL RESIN VERSAMATRIX A/S (DK) 2006-03-02 WO disclosed