SCHEMBL2562453

SCHEMBL2562453

COCCNc1nc2ccccn2c(=O)c1C=O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.54
GAA P10253 3/20 0.54
RAB9A P51151 1/20 0.54
MAPT P10636 3/20 0.52
NPSR1 Q6W5P4 3/20 0.52
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 7/20 0.49
HPGD P15428 2/20 0.49
L3MBTL1 Q9Y468 3/20 0.48
LMNA P02545 2/20 0.48
HTT P42858 1/20 0.47
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.46
RXFP1 Q9HBX9 2/20 0.46
MEN1 O00255 1/20 0.45
TRIM24 O15164 1/20 0.45
TRIM33 Q9UPN9 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL2227992 0.86 KDM4E (0.56) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL2228132 0.79 KDM4E (0.56) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL15330012 0.79 KDM4E (0.73) KDM4EGAARAB9AMAPTNPSR1
Water SCHEMBL2228975 0.78 KDM4E (0.54) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL2227265 0.77 KDM4E (0.54) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL2227626 0.75 ALDH1A1 (0.74) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL15331447 0.74 TBK1 (0.57) KDM4EGAARAB9AMAPTNPSR1
Water SCHEMBL2227396 0.74 ALDH1A1 (0.73) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL15332129 0.73 NPC1 (0.62) KDM4EGAARAB9AMAPTNPSR1
SCHEMBL2227307 0.72 KDM4E (0.60) KDM4EGAARAB9AMAPTNPSR1

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