SCHEMBL2561496

SCHEMBL2561496

CC(=O)n1cc(/C=C/C=O)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.54
MEN1 O00255 6/20 0.54
MAPT P10636 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 1/20 0.52
RAB9A P51151 3/20 0.49
POLB P06746 7/20 0.48
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HPGD P15428 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 2/20 0.46
ACHE P22303 1/20 0.45
CREBBP Q92793 3/20 0.44
HSD17B10 Q99714 1/20 0.44
BRPF1 P55201 1/20 0.44

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
SCHEMBL2561497 1.00 KMT2A (0.54) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL870631 0.84 KMT2A (0.59) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL6545595 0.80 KMT2A (0.62) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL14570850 0.79 KMT2A (0.52) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL8351814 0.79 MAPT (0.54) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL8351815 0.79 MAPT (0.54) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL8351810 0.79 MAPT (0.54) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL3866851 0.78 ALDH1A1 (0.73) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL3695560 0.78 ALDH1A1 (0.69) KMT2AMEN1MAPTSMN1; SMN2GAA
SCHEMBL3695559 0.78 ALDH1A1 (0.69) KMT2AMEN1MAPTSMN1; SMN2GAA

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