SCHEMBL2554537

SCHEMBL2554537

CNC(=O)CCOc1c(C=O)cccc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
SRC P12931 1/20 0.50
NFE2L2 Q16236 3/20 0.47
TLR2 O60603 1/20 0.47
ERN1 O75460 1/20 0.47
TLR1 Q15399 1/20 0.47
TLR6 Q9Y2C9 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ALDH1A1 P00352 3/20 0.43
GAA P10253 1/20 0.43
KDM4E B2RXH2 2/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 3/20 0.42
HPGD P15428 2/20 0.42
HTR1A P08908 1/20 0.41

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
SCHEMBL2557845 0.88 GAA (0.42) NPC1RAB9ASRCTLR2ERN1
SCHEMBL29956589 0.87 RAB9A (0.50) NPC1RAB9ASRCNFE2L2TLR2
SCHEMBL2555240 0.86 SRC (0.56) NPC1RAB9ASRCNFE2L2TLR2
SCHEMBL2559195 0.86 NPC1 (0.49) NPC1RAB9ASRCNFE2L2TLR2
SCHEMBL29951179 0.84 MAPT (0.49) NPC1RAB9ASRCL3MBTL1ALDH1A1
SCHEMBL2558191 0.84 NPC1 (0.54) NPC1RAB9ASRCNFE2L2TLR2
SCHEMBL15331738 0.83 ALDH1A1 (0.61) NPC1RAB9ASRCSMN1; SMN2ALDH1A1
SCHEMBL2561362 0.83 CA1 (0.38) NPC1RAB9ATSHRSMN1; SMN2CA1
SCHEMBL20150688 0.81 NPC1 (0.51) NPC1RAB9ASRCNFE2L2TLR2
SCHEMBL7357540 0.80 NPC1 (0.59) NPC1RAB9ASRCNFE2L2TLR2

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