SCHEMBL6543395

SCHEMBL6543395

OC[C@H](O)c1ccc2ccccc2c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 5/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
AOC3 Q16853 1/20 0.59
CYP1A2 P05177 1/20 0.59
TSHR P16473 1/20 0.59
HIF1A Q16665 1/20 0.59
UGT2B7 P16662 1/20 0.59
SLC6A2 P23975 12/20 0.50
SLC6A4 P31645 12/20 0.50
SLC6A3 Q01959 12/20 0.50
KCNH2 Q12809 8/20 0.50
CYP3A4 P08684 2/20 0.50
HDAC1 Q13547 1/20 0.50
ATM Q13315 1/20 0.50
HDAC8 Q9BY41 1/20 0.50

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
SCHEMBL6490271 1.00 CYP2D6 (0.59) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL2894556 1.00 CYP2D6 (0.59) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL3266869 0.85 UGT2B7 (0.61) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL13801033 0.84 CYP2D6 (0.56) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL9043925 0.82 HDAC1 (0.57) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL10120474 0.82 UGT2B7 (0.62) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL4945583 0.82 SLC6A2 (0.62) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL483715 0.82 UGT2B7 (0.62) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL7229252 0.82 CYP2D6 (0.57) CYP2D6MEN1KMT2AAOC3CYP1A2
SCHEMBL894256 0.82 CYP2D6 (0.57) CYP2D6MEN1KMT2AAOC3CYP1A2

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-1175379-B1 METHOD FOR THE ASYMMETRIC DIHYDROXYLATION OF OLEFINS, USING OSMIUM CATALYSTS BAYER CHEMICALS AG (DE) 2004-01-02 EP disclosed
US-6472570-B1 Method for the asymmetric dihydroxylation of olefins, using osmium catalysts BAYER AKTIENGESELLSCHAFT (DE) 2002-10-29 US disclosed
EP-1175379-A1 METHOD FOR THE ASYMMETRIC DIHYDROXYLATION OF OLEFINS, USING OSMIUM CATALYSTS Bayer Aktiengesellschaft (DE) 2002-01-30 EP disclosed
WO-2000064844-A1 METHOD FOR THE ASYMMETRIC DIHYDROXYLATION OF OLEFINS, USING OSMIUM CATALYSTS BAYER AKTIENGESELLSCHAFT (DE) 2000-11-02 WO disclosed