SCHEMBL14747281

SCHEMBL14747281

OCC(OCc1ccccc1)[C@H](OCc1ccccc1)[C@H](O)COCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
KMT2A Q03164 1/20 0.46
TACR1 P25103 3/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.40
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
PRKCA P17252 1/20 0.39
SLC1A1 P43005 1/20 0.38

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
SCHEMBL1054215 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL29697165 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL1053924 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL9345489 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL19390430 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL14372163 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL14747283 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL9838648 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL6101469 1.00 CA1 (0.47) CA1CA2CA7CA9KMT2A
SCHEMBL15721071 0.95 CA1 (0.46) CA1CA2CA7CA9KMT2A

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-8389565-B2 Antidiabetic agents; controlling carbohydrate metabolism SIMON FRASER UNIVERSITY (CA) 2013-03-05 US disclosed