SCHEMBL2562201

SCHEMBL2562201

Cc1cccn2c(=O)c(C=O)c(N3CCN(C)CC3)nc12

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.80
MAPT P10636 5/20 0.80
KDM4E B2RXH2 3/20 0.80
HTT P42858 1/20 0.80
MAPK1 P28482 1/20 0.77
LMNA P02545 1/20 0.74
RXFP1 Q9HBX9 3/20 0.71
KMT2A Q03164 4/20 0.70
CYP1A2 P05177 2/20 0.70
CYP3A4 P08684 2/20 0.70
CYP2C19 P33261 2/20 0.70
L3MBTL1 Q9Y468 1/20 0.67
POLB P06746 1/20 0.65
HPGD P15428 3/20 0.62
NPSR1 Q6W5P4 2/20 0.62
MEN1 O00255 2/20 0.62
TDP1 Q9NUW8 1/20 0.62
TSHR P16473 1/20 0.60
RECQL P46063 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.58

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
SCHEMBL29951831 0.90 ALDH1A1 (0.97) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL15330150 0.89 ALDH1A1 (1.00) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL15887231 0.89 ALDH1A1 (1.00) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL29954626 0.87 MAPK1 (1.00) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL2214575 0.87 ALDH1A1 (0.78) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL15332277 0.86 ALDH1A1 (0.77) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL2215671 0.85 ALDH1A1 (0.76) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL2217889 0.83 ALDH1A1 (0.69) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL2553969 0.81 L3MBTL1 (0.78) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL15330999 0.80 POLB (0.97) ALDH1A1MAPTKDM4ELMNARXFP1

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