SCHEMBL2558142

SCHEMBL2558142

CN(C)CC(=O)N1CCN(c2ccc(B(O)O)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
RET P07949 1/20 0.44
POLB P06746 1/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
AKR1C3 P42330 1/20 0.43
NAMPT P43490 1/20 0.42
CDK2 P24941 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ME2 P23368 1/20 0.42
ME1 P48163 1/20 0.42
ME3 Q16798 1/20 0.42

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
SCHEMBL14924440 0.84 HTT (0.57) MEN1KMT2AHPGDSMN1; SMN2POLB
SCHEMBL2387391 0.82 GFER (0.62) MEN1KMT2AHPGDSMN1; SMN2POLB
SCHEMBL20387730 0.82 MAPT (0.64) MEN1KMT2AHPGDSMN1; SMN2MAPT
SCHEMBL11919049 0.81 MAPT (0.53) MEN1KMT2AHPGDSMN1; SMN2POLB
SCHEMBL14923975 0.80 SMN1; SMN2 (0.52) MEN1KMT2AHPGDSMN1; SMN2POLB
SCHEMBL11916169 0.80 MAPT (0.54) MEN1KMT2AHPGDSMN1; SMN2POLB
SCHEMBL187777 0.79 SMN1; SMN2 (0.49) MEN1KMT2AHPGDSMN1; SMN2RET
SCHEMBL21273927 0.79 GFER (0.65) MEN1KMT2AHPGDSMN1; SMN2MAPT
SCHEMBL12557583 0.74 AKR1C3 (0.57) MEN1KMT2AHPGDSMN1; SMN2RET
SCHEMBL2556023 0.73 KMT2A (0.38) MEN1KMT2AHPGDPOLBMAPT

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