SCHEMBL2551243

SCHEMBL2551243

NC(=O)c1ccccc1OCC=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.59
MAPT P10636 4/20 0.55
KMT2A Q03164 3/20 0.55
HTT P42858 3/20 0.55
PARP1 P09874 3/20 0.55
LMNA P02545 3/20 0.55
MEN1 O00255 2/20 0.55
NR1I2 O75469 1/20 0.55
CHRM2 P08172 1/20 0.55
CYP3A4 P08684 1/20 0.55
ADRA2A P08913 1/20 0.55
OPRK1 P41145 1/20 0.55
HTR2B P41595 1/20 0.55
SLC6A3 Q01959 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
CTNNB1 P35222 1/20 0.51
IRAK4 Q9NWZ3 1/20 0.50
LIG1 P18858 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL3798396 0.84 KDM4E (0.71) KDM4EMAPTKMT2AHTTPARP1
SCHEMBL1524367 0.84 ALDH1A1 (0.61) KDM4EMAPTKMT2AHTTLMNA
SCHEMBL30961481 0.84 ALDH1A1 (0.61) KDM4EMAPTKMT2AHTTLMNA
SCHEMBL2562816 0.83 KDM4E (0.74) KDM4EMAPTKMT2AHTTPARP1
SCHEMBL7788841 0.81 MAPT (0.55) KDM4EMAPTKMT2AHTTPARP1
SCHEMBL27470405 0.81 MAPT (0.59) KDM4EMAPTKMT2AHTTPARP1
SCHEMBL27537822 0.81 MAPT (0.62) KDM4EMAPTKMT2AHTTPARP1
SCHEMBL15525445 0.79 MAPT (0.60) KDM4EMAPTKMT2AHTTPARP1
SCHEMBL7325672 0.79 PARP1 (0.60) KDM4EMAPTKMT2AHTTPARP1
SCHEMBL8399357 0.79 ALDH1A1 (0.54) KDM4EMAPTKMT2AHTTLMNA

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