SCHEMBL21963659

SCHEMBL21963659

CC1(C)O[C@@H]2O[C@@H]([C@@H](O)CO)[C@H](OCc3ccccc3)[C@@H]2O1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
LMNA P02545 1/20 0.60
CYP1A2 P05177 1/20 0.60
THPO P40225 1/20 0.60
ALDH1A1 P00352 2/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
ATM Q13315 1/20 0.43
HTT P42858 3/20 0.35
GLB1 P16278 1/20 0.34
PDPK1 O15530 1/20 0.34
MTOR P42345 1/20 0.34
PTPN1 P18031 1/20 0.33
CDC25B P30305 1/20 0.33
IDO1 P14902 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
TACR2 P21452 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
SCHEMBL4804191 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL21135338 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL22335649 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL24063582 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL13495796 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL24772408 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL23969062 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL23990344 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL22236573 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO
SCHEMBL10148608 1.00 MEN1 (0.70) MEN1KMT2ALMNACYP1A2THPO

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
EP-3880837-A1 STREPTAVIDIN-COATED SOLID PHASES WITH A MEMBER OF A BINDING PAIR F. Hoffmann-La Roche AG (CH) 2021-09-22 EP disclosed
WO-2020099533-A1 STREPTAVIDIN-COATED SOLID PHASES WITH A MEMBER OF A BINDING PAIR F. HOFFMANN-LA ROCHE AG (CH) 2020-05-22 WO disclosed