SCHEMBL2555765

SCHEMBL2555765

CN(CCOc1ccc(B(O)O)cc1)CC1CCC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LSS P48449 2/20 0.46
KCNH2 Q12809 1/20 0.38
ADRA1A P35348 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
ENPP2 Q13822 1/20 0.37
ADRA1B P35368 1/20 0.36
TSHR P16473 1/20 0.36
DRD2 P14416 1/20 0.36
NFE2L2 Q16236 1/20 0.35
LTA4H P09960 1/20 0.35
ESR1 P03372 1/20 0.35

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
SCHEMBL2561427 0.85 ENPP2 (0.42) LSSADRA1AENPP2ADRA1B
SCHEMBL2556400 0.81 LSS (0.43) LSSCA1CA2ENPP2LTA4H
SCHEMBL1020230 0.76 HRH3 (0.58) KCNH2CA1CA2ENPP2DRD2
SCHEMBL2561036 0.74 DRD3 (0.39) CA1CA2ENPP2DRD2
SCHEMBL2557697 0.73 FDPS (0.47) KCNH2CA1CA2ENPP2TSHR
SCHEMBL2555790 0.73 LPL (0.45) KCNH2CA1CA2LTA4HESR1
SCHEMBL2560769 0.73 KCNH2 (0.40) KCNH2CA1CA2ENPP2TSHR
SCHEMBL2556749 0.73 KCNH2 (0.43) KCNH2CA1CA2ENPP2TSHR
SCHEMBL20830808 0.71 NFE2L2 (0.51) CA1CA2ENPP2NFE2L2
SCHEMBL5637547 0.71 KDM4E (0.62) LSSCA1CA2ENPP2NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
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
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed