SCHEMBL29953582

SCHEMBL29953582

N#Cc1c(Cl)cccc1N1CCC[C@H](C(=O)O)C1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.62
ALDH1A1 P00352 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
GAA P10253 1/20 0.60
NOTUM Q6P988 14/20 0.59
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
DPP4 P27487 1/20 0.42
PREP P48147 1/20 0.42
DPP9 Q86TI2 1/20 0.42
DPP7 Q9UHL4 1/20 0.42
AKR1C3 P42330 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
SCHEMBL2560235 1.00 KDM4E (0.62) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL29950907 1.00 KDM4E (0.62) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL2557367 0.92 GAA (0.70) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL29957636 0.86 NOTUM (0.48) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL2560204 0.86 NOTUM (0.59) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL29955236 0.86 NOTUM (0.59) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL29953136 0.86 NOTUM (0.48) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL2560607 0.86 NOTUM (0.48) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL29952998 0.86 NOTUM (0.59) KDM4EALDH1A1L3MBTL1GAANOTUM
SCHEMBL2558768 0.84 GAA (0.78) KDM4EALDH1A1L3MBTL1GAANOTUM

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 1 patent. 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