SCHEMBL2557955

SCHEMBL2557955

CC(C)c1ncccc1C=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.53
TRIM33 Q9UPN9 2/20 0.53
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HSP90AA1 P07900 1/20 0.41
IDO1 P14902 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TSHR P16473 1/20 0.40
ERN1 O75460 1/20 0.37
CCR1 P32246 1/20 0.36
CCR5 P51681 1/20 0.36

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
SCHEMBL30241147 0.82 TRIM24 (0.52) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL6310182 0.81 TRIM24 (0.47) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL16296456 0.81 TRIM24 (0.43) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL20851271 0.79 ALDH1A1 (0.35) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL19779875 0.79 TRIM24 (0.35) TRIM24TRIM33NPC1KDM4EHSP90AA1
Formamide SCHEMBL9540188 0.76 CHRNA7 (0.40) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL24833024 0.75 CCR1 (0.41) TRIM24TRIM33LMNAALDH1A1CCR1
SCHEMBL19769027 0.75 ALDH1A1 (0.49) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL19880469 0.75 ALDH1A1 (0.49) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL29948333 0.74

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