SCHEMBL2556740

SCHEMBL2556740

O=Cc1cccc(-c2cccc(C(=O)O)c2)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 8/20 0.61
ALDH1A1 P00352 2/20 0.50
POLB P06746 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KMO O15229 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
PLCG1 P19174 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
FOLH1 Q04609 2/20 0.49
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
UNG P13051 1/20 0.49
DDT P30046 1/20 0.48

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
SCHEMBL5268533 0.87 ERN1 (0.60) ERN1ALDH1A1POLBL3MBTL1KMO
SCHEMBL2560703 0.86 ERN1 (0.62) ERN1
Water SCHEMBL4263608 0.86 ERN1 (0.59) ERN1ALDH1A1POLBL3MBTL1KMO
SCHEMBL2561443 0.84 ERN1 (0.53) ERN1ALDH1A1POLBL3MBTL1MEN1
SCHEMBL2560275 0.82 ERN1 (0.51) ERN1ALDH1A1POLBL3MBTL1MEN1
SCHEMBL29954336 0.82 ERN1 (0.48) ERN1
SCHEMBL31364059 0.81 ERN1 (0.55) ERN1ALDH1A1MEN1THRBKMT2A
SCHEMBL1043113 0.81 ERN1 (0.55) ERN1ALDH1A1MEN1THRBKMT2A
SCHEMBL29957068 0.81 ERN1 (0.61) ERN1L3MBTL1MEN1NPC1RAB9A
SCHEMBL407375 0.80 KMO (0.56) ERN1ALDH1A1POLBKMOMEN1

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