SCHEMBL2555142

SCHEMBL2555142

Cc1cc(C=O)nc(CC(N)=O)n1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.71
ALDH1A1 P00352 4/20 0.35
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.33
BTK Q06187 1/20 0.32
ACHE P22303 3/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
MAPT P10636 1/20 0.30
GAA P10253 1/20 0.30
BCHE P06276 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL2091085 0.84 HTT (1.00) HTTALDH1A1POLBACHERAB9A
SCHEMBL29952437 0.79 HTT (0.40) HTTALDH1A1POLBKMT2AMEN1
SCHEMBL29957984 0.77 HTT (0.37) HTTALDH1A1CYP1A2MAPTKDM4E
SCHEMBL29955735 0.74 HTT (0.35) HTTALDH1A1POLBRAB9AL3MBTL1
SCHEMBL29952038 0.72 HTT (0.34) HTTALDH1A1POLBL3MBTL1GAA
SCHEMBL2555883 0.71 HTT (0.41) HTTALDH1A1ACHERAB9AL3MBTL1
SCHEMBL29956524 0.69 ERN1 (0.35) HTTALDH1A1POLBKDM4E
SCHEMBL13724354 0.69 GRM4 (0.53) POLBTSHRRAB9ACYP1A2MAPT
SCHEMBL3089372 0.68 ALDH1A1 (0.36) ALDH1A1POLBRAB9ACYP1A2KMT2A
SCHEMBL29952455 0.68 ALDH1A1 (0.36) ALDH1A1POLBRAB9ACYP1A2KMT2A

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