SCHEMBL2557573

SCHEMBL2557573

N#Cc1c(F)cccc1N1CCC(C(=O)O)CC1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.67
ALDH1A1 P00352 2/20 0.58
HPGD P15428 1/20 0.58
HSD17B10 Q99714 1/20 0.58
GAA P10253 1/20 0.57
NOTUM Q6P988 8/20 0.57
DRD2 P14416 1/20 0.47
HTR2A P28223 1/20 0.47
HRH1 P35367 1/20 0.47
GRM2 Q14416 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CYP2C19 P33261 1/20 0.42
DPP4 P27487 1/20 0.42
DPP9 Q86TI2 1/20 0.42
MTOR P42345 1/20 0.42
RPTOR Q8N122 1/20 0.42
MLST8 Q9BVC4 1/20 0.42
KMT2A Q03164 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
SCHEMBL2073370 0.88 GAA (0.74) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL2558768 0.85 GAA (0.78) KDM4EALDH1A1GAANOTUML3MBTL1
SCHEMBL29952998 0.85 NOTUM (0.59) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL29955236 0.85 NOTUM (0.59) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL2560204 0.85 NOTUM (0.59) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL2555803 0.84 GAA (0.57) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL13622686 0.83 KDM4E (0.62) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL5798527 0.83 NOTUM (0.59) KDM4EGAANOTUMCYP2C19DPP4
SCHEMBL5800615 0.81 NOTUM (0.82) KDM4EALDH1A1HSD17B10GAANOTUM
SCHEMBL2072485 0.80 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10GAA

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