SCHEMBL15330876

SCHEMBL15330876

O[B-](O)(O)c1cc(C2OCCO2)ccn1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 1/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
GSK3B P49841 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
CCNB3 Q8WWL7 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RAB9A P51151 1/20 0.32
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31

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
Lithium Ion SCHEMBL29955540 0.98 CCNB2 (0.35) CCNB2CDK1CCNB1GSK3BCDK5
SCHEMBL9518449 0.73 CCNB2 (0.39) CCNB2CDK1CCNB1GSK3BCDK5
Lithium Ion SCHEMBL30693025 0.72 CCNB2 (0.33) CCNB2CDK1CCNB1GSK3BCDK5
SCHEMBL17053251 0.70 CCNB2 (0.37) CCNB2CDK1CCNB1GSK3BCDK5
SCHEMBL17687863 0.68 MEN1 (0.37) MEN1KMT2ARAB9A
SCHEMBL17687972 0.68 PIK3CA (0.36) CCNB2CDK1CCNB1GSK3BCDK5
Lithium Ion SCHEMBL17687949 0.67 MEN1 (0.36) MEN1KMT2ARAB9A
Pyridine, 4-(1,3-Dioxalan-2-Yl) SCHEMBL3965171 0.66 ALDH1A1 (0.44) CCNB2CDK1CCNB1GSK3BCDK5
SCHEMBL17053249 0.66 ALDH1A1 (0.34) CCNB2CDK1CCNB1GSK3BCDK5
SCHEMBL17115214 0.65 CCNB2 (0.33) CCNB2CDK1CCNB1GSK3BCDK5

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
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed