SCHEMBL2557692

SCHEMBL2557692

NC(=O)c1cccnc1N1CCCC(C=O)C1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 1/20 0.41
RECQL P46063 1/20 0.41
OPRK1 P41145 7/20 0.41
RBP4 P02753 1/20 0.40
TTR P02766 1/20 0.40
PRKCQ Q04759 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PARP1 P09874 1/20 0.40
RPS6KB1 P23443 1/20 0.39
NPC1 O15118 1/20 0.39
CAPN1 P07384 1/20 0.39
CTSS P25774 1/20 0.39

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
SCHEMBL2560551 0.85 KMT2A (0.54) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL883905 0.80 KMT2A (0.58) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL28189129 0.79 KMT2A (0.60) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL29173062 0.78 KMT2A (0.52) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL29835066 0.78 KMT2A (0.52) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL29421198 0.78 KMT2A (0.52) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL29421239 0.75 RBP4 (0.51) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL29421232 0.75 RBP4 (0.51) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL2554778 0.74 KMT2A (0.44) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL2562359 0.74 USP30 (0.41)

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