SCHEMBL2551648

SCHEMBL2551648

CN(C)CCOc1cc(B(O)O)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.46
KDM4E B2RXH2 8/20 0.44
ALDH1A1 P00352 4/20 0.44
MAPT P10636 1/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.42
ENPP2 Q13822 1/20 0.41
HTR7 P34969 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HTR1B P28222 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
SCHEMBL4881084 0.83 CSNK2A1 (0.44) KDM4EALDH1A1MAPTGAAMAPK1
SCHEMBL29953019 0.83 CSNK2A1 (0.44) KDM4EALDH1A1MAPTGAAMAPK1
SCHEMBL2557452 0.82 HTR7 (0.49) KDM4EALDH1A1ENPP2HTR7HTR2A
SCHEMBL29956963 0.81 ENPP2 (0.43) KDM4EALDH1A1MAPTMAPK1ENPP2
SCHEMBL2561475 0.81 L3MBTL1 (0.46) KDM4EALDH1A1MAPTGAAMAPK1
SCHEMBL2561929 0.80 KDM4E (0.59) KDM4EALDH1A1GAAMAPK1HTR7
SCHEMBL29956646 0.79 ENPP2 (0.46) ALDH1A1MAPTGAAENPP2SMN1; SMN2
SCHEMBL2854999 0.79 ENPP2 (0.46) ALDH1A1MAPTGAAENPP2SMN1; SMN2
SCHEMBL1823460 0.79 THRA (0.45) KDM4EALDH1A1GAAMAPK1HTR7
SCHEMBL2558982 0.78 MAPT (0.45) UTS2RKDM4EALDH1A1MAPTGAA

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