SCHEMBL2553993

SCHEMBL2553993

OB(O)c1ccccc1COCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.47
LIPG Q9Y5X9 1/20 0.45
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
ENPP2 Q13822 2/20 0.37
TSHR P16473 1/20 0.36
ABCB1 P08183 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL24107427 0.79 LIPG (0.43) LIPELIPGCA2L3MBTL1ENPP2
SCHEMBL29014484 0.78 LIPG (0.58) LIPELIPGCA1CA2TDP1
SCHEMBL1837572 0.77 MPO (0.50) CA1CA2L3MBTL1ESR1ESR2
SCHEMBL29952834 0.77 LIPG (0.52) LIPELIPGTDP1L3MBTL1ENPP2
SCHEMBL12544470 0.77 LIPG (0.52) LIPELIPGTDP1L3MBTL1ENPP2
SCHEMBL29951742 0.77 LIPG (0.62) LIPGTSHR
SCHEMBL2408016 0.75 TRPV6 (0.41) LIPELIPGENPP2
SCHEMBL8124493 0.75 TRPV1 (0.48) LIPGCA1CA2TDP1L3MBTL1
SCHEMBL29958276 0.75 TRPV1 (0.48) LIPGCA1CA2TDP1L3MBTL1
SCHEMBL2558687 0.74 ENPP2 (0.60) LIPGENPP2

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