SCHEMBL2561446

SCHEMBL2561446

Cc1cc(C)cc(OCc2ccccc2B(O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
LIPE Q05469 1/20 0.40
MAOB P27338 1/20 0.39
F2 P00734 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GRM5 P41594 1/20 0.38
IDH1 O75874 1/20 0.37
ENPP2 Q13822 1/20 0.37
LMNA P02545 1/20 0.37
PTGER4 P35408 1/20 0.37
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 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
SCHEMBL1260133 0.82 LIPG (0.50) LIPGSMN1; SMN2LIPEMAOBF2
SCHEMBL15329780 0.82 SLC6A2 (0.43) LIPGLIPEMAOBENPP2
SCHEMBL20578562 0.82 ENPP2 (0.46) LIPGLIPEMAOBF2ENPP2
SCHEMBL2558709 0.81 ESR1 (0.48) SMN1; SMN2MAOBL3MBTL1TDP1MAPT
SCHEMBL15332971 0.78 LIPG (0.46) LIPGSMN1; SMN2LIPEMAOBF2
SCHEMBL2556560 0.78 MAOB (0.57) SMN1; SMN2MAOBENPP2LMNATSHR
SCHEMBL2558583 0.77 LIPG (0.44) LIPGLIPEMAOBENPP2LMNA
SCHEMBL2556977 0.77 MAPT (0.49) SMN1; SMN2MAOBL3MBTL1MAPTHPGD
SCHEMBL17236560 0.77 LIPG (0.45) LIPGLIPEMAOBF2
SCHEMBL2562456 0.77 MAOB (0.48) LIPGSMN1; SMN2MAOBF2ENPP2

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