SCHEMBL2557771

SCHEMBL2557771

Nc1c(C=O)c(=O)[nH]c(=O)n1Cc1ccco1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
ALDH1A1 P00352 9/20 0.56
MEN1 O00255 8/20 0.56
KMT2A Q03164 8/20 0.56
MAPT P10636 6/20 0.56
PKM P14618 6/20 0.56
POLB P06746 5/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 1/20 0.56
GAA P10253 1/20 0.51
KDM4E B2RXH2 4/20 0.51
RECQL P46063 2/20 0.51
BLM P54132 2/20 0.51
CTDSP1 Q9GZU7 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
APEX1 P27695 1/20 0.51
UHRF1 Q96T88 1/20 0.51
MAPK1 P28482 1/20 0.50
PNP P00491 2/20 0.47

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
SCHEMBL8135676 0.83 TSHR (0.62) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL2561798 0.73 HPGD (0.49) ALDH1A1MEN1KMT2AMAPTPKM
SCHEMBL8133362 0.72 TSHR (1.00) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL2561805 0.71 KMT2A (0.54) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL1958885 0.70 TSHR (0.52) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL11362739 0.70 TSHR (0.59) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL8142359 0.67 MEN1 (0.67) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL1960199 0.67 ALDH1A1 (0.49) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL6346663 0.66 ADORA2A (0.59) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL2588131 0.66 TSHR (1.00) TSHRALDH1A1MEN1KMT2AMAPT

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