SCHEMBL2561443

SCHEMBL2561443

O=Cc1cccc(-c2ccc(C(=O)O)cc2)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 10/20 0.53
TRIM24 O15164 1/20 0.49
TRIM33 Q9UPN9 1/20 0.49
FOLH1 Q04609 1/20 0.47
TTR P02766 1/20 0.46
HNF4A P41235 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
PLCG1 P19174 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TLR2 O60603 1/20 0.41

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
SCHEMBL2557520 0.85 ERN1 (0.54) ERN1TLR2TLR1TLR6
SCHEMBL3556722 0.84 ERN1 (0.53) ERN1TRIM24TRIM33FOLH1ALDH1A1
SCHEMBL29950910 0.84 ERN1 (0.53) ERN1TRIM24TRIM33FOLH1ALDH1A1
SCHEMBL1043113 0.84 ERN1 (0.55) ERN1TRIM24TRIM33HNF4AALDH1A1
SCHEMBL31364059 0.84 ERN1 (0.55) ERN1TRIM24TRIM33HNF4AALDH1A1
SCHEMBL2556740 0.84 ERN1 (0.61) ERN1FOLH1ALDH1A1MEN1NPC1
SCHEMBL13006172 0.81 ERN1 (0.57) ERN1ALDH1A1MEN1MAPTKMT2A
SCHEMBL2560945 0.79 ERN1 (0.50) ERN1TRIM24TRIM33HNF4AALDH1A1
SCHEMBL5735298 0.79 ERN1 (0.52) ERN1TRIM24TRIM33TLR2TLR1
SCHEMBL5735469 0.79 ERN1 (0.56) ERN1TRIM24TRIM33POLBTLR2

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