SCHEMBL2558950

SCHEMBL2558950

CCCCNC(=O)COc1c(C)cc(C=O)cc1C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
LMNA P02545 3/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 3/20 0.43
SRC P12931 1/20 0.43
TSHR P16473 2/20 0.43
RECQL P46063 1/20 0.43
HTT P42858 2/20 0.42
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
HPGD P15428 2/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 1/20 0.40
FAAH O00519 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL2559119 0.92 BCHE (0.49) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2558898 0.86 ALDH1A1 (0.56) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2560642 0.84 HPGD (0.56) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2556701 0.82 LMNA (0.43) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2554336 0.80 ALDH1A1 (0.54) ALDH1A1LMNAKMT2ASRCBCHE
SCHEMBL2558870 0.80 ALDH1A1 (0.56) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2561651 0.80 SMN1; SMN2 (0.46) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2557183 0.80 SRC (0.44) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2559225 0.80 SRC (0.44) ALDH1A1LMNAMAPTKMT2ASRC
SCHEMBL2562712 0.78 KDM4E (0.46) ALDH1A1LMNAMAPTKMT2ASRC

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