SCHEMBL2559587

SCHEMBL2559587

CCNC(=O)COc1c(Cl)cc(C=O)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.64
L3MBTL1 Q9Y468 1/20 0.57
MAPK1 P28482 1/20 0.49
POLB P06746 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 2/20 0.46
MAPT P10636 3/20 0.45
KDM4E B2RXH2 1/20 0.45
THRB P10828 1/20 0.45
HPGD P15428 2/20 0.45
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PKM P14618 1/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL2558197 0.91 ALDH1A1 (0.71) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL2560562 0.90 ALDH1A1 (0.55) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL15331687 0.88 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL2553581 0.87 ALDH1A1 (0.62) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL2563609 0.87 ALDH1A1 (0.51) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL2558921 0.87 ALDH1A1 (0.51) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL15329949 0.87 ALDH1A1 (0.55) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL2560442 0.85 ALDH1A1 (0.60) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL15333341 0.84 ALDH1A1 (0.56) ALDH1A1L3MBTL1MAPK1POLBSMN1; SMN2
SCHEMBL29955369 0.83 ALDH1A1 (0.60) ALDH1A1L3MBTL1MAPK1POLBTSHR

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