SCHEMBL2560580

SCHEMBL2560580

CC(C)c1ccc2[nH]c(-c3cccc(F)c3F)c(C=O)c2c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
KIF11 P52732 1/20 0.39
EIF4A3 P38919 1/20 0.36
DYRK1A Q13627 3/20 0.36
GAA P10253 1/20 0.35
TLR9 Q9NR96 2/20 0.33
TLR8 Q9NR97 2/20 0.33
TLR7 Q9NYK1 2/20 0.33
PGR P06401 1/20 0.33
HTR1D P28221 1/20 0.32
DHODH Q02127 1/20 0.32
CNR1 P21554 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
PTPN1 P18031 1/20 0.32
WNT1 P04628 2/20 0.32

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
SCHEMBL2559306 0.90 KIF11 (0.43) KDM4EKIF11EIF4A3GAAPGR
SCHEMBL15329799 0.86 KDM4E (0.42) KDM4EKIF11EIF4A3GAATLR8
SCHEMBL2554943 0.84 MEN1 (0.40) KDM4E
SCHEMBL2551058 0.84 KDM4E (0.42) KDM4EGAA
SCHEMBL15330817 0.82 KDM4E (0.41) KDM4EKIF11EIF4A3GAATLR9
SCHEMBL15331589 0.82 KDM4E (0.41) KDM4EKIF11EIF4A3GAAHTR1D
SCHEMBL2558625 0.81 KDM4E (0.45) KDM4EKIF11GAATLR9
SCHEMBL15330490 0.81 AHR (0.42) KDM4EGAA
SCHEMBL2557019 0.81 AHR (0.45) KDM4E
SCHEMBL2560242 0.81 KIF11 (0.43) KDM4EKIF11GAATLR9TLR7

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