SCHEMBL2559079

SCHEMBL2559079

CC(=O)c1ccc(OCc2occc2C(=O)O)cc1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.74
MAOB P27338 14/20 0.54
L3MBTL1 Q9Y468 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAOA P21397 3/20 0.48
GAA P10253 1/20 0.47
PTGER4 P35408 1/20 0.47
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL2560777 0.84 TP53 (0.60) TP53MAOBMAOA
SCHEMBL15332552 0.80 TP53 (0.70) TP53L3MBTL1ALDH1A1SMN1; SMN2LMNA
SCHEMBL15330025 0.77 L3MBTL1 (0.65) TP53MAOBL3MBTL1ALDH1A1HTT
SCHEMBL11669106 0.75 TP53 (0.62) TP53L3MBTL1ALDH1A1HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL11669190 0.73 TP53 (0.60) TP53L3MBTL1ALDH1A1HTTSMN1; SMN2
SCHEMBL2559526 0.71 MAOB (0.54) MAOBL3MBTL1ALDH1A1HTTSMN1; SMN2
SCHEMBL42302 0.70 MAOB (1.00) MAOBL3MBTL1ALDH1A1HTTSMN1; SMN2
SCHEMBL2558347 0.70 POLB (0.81) MAOBL3MBTL1ALDH1A1HTTSMN1; SMN2
SCHEMBL2223238 0.69 TP53 (0.54) TP53L3MBTL1ALDH1A1SMN1; SMN2LMNA
SCHEMBL834525 0.69 L3MBTL1 (0.88) MAOBL3MBTL1ALDH1A1MAOAGAA

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