SCHEMBL2556032

SCHEMBL2556032

Cc1cc(C=O)c(O)c([C@H](N)[C@@H](C)O)c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 12/20 0.56
SRC P12931 2/20 0.36
TYR P14679 1/20 0.33
GRK6 P43250 1/20 0.32
ALB P02768 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL15331637 1.00 ERN1 (0.56) ERN1SRCTYRGRK6ALB
SCHEMBL15331547 0.89 ERN1 (0.58) ERN1SRCTYRGRK6ALB
SCHEMBL15331567 0.89 ERN1 (0.58) ERN1SRCTYRGRK6ALB
SCHEMBL2561671 0.85 ERN1 (0.62) ERN1SRCTYRGRK6ALB
SCHEMBL15330321 0.85 ERN1 (0.62) ERN1SRCTYRGRK6ALB
SCHEMBL310863 0.81 ERN1 (0.67) ERN1SRCTYRALBALDH1A1
SCHEMBL15329806 0.77 ERN1 (0.56) ERN1SRCGRK6ALDH1A1SMN1; SMN2
SCHEMBL15330948 0.77 ERN1 (0.56) ERN1SRCGRK6ALBALDH1A1
SCHEMBL29956854 0.77 ERN1 (0.56) ERN1SRCGRK6ALDH1A1
SCHEMBL15331019 0.77 ERN1 (0.56) ERN1SRCGRK6

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