SCHEMBL2556757

SCHEMBL2556757

C#CCNC(=O)COc1c(C=O)cccc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.50
HSD17B10 Q99714 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
NFE2L2 Q16236 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 1/20 0.44
TLR2 O60603 1/20 0.43
ERN1 O75460 1/20 0.43
TLR1 Q15399 1/20 0.43
TLR6 Q9Y2C9 1/20 0.43
CA2 P00918 2/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
GAA P10253 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
SCHEMBL2562065 0.89 LMNA (0.44) SRCHSD17B10NPC1RAB9APOLB
SCHEMBL29952098 0.88 SRC (0.50) SRCHSD17B10NPSR1NFE2L2NPC1
SCHEMBL29952197 0.86 ALDH1A1 (0.56) SRCHSD17B10NPSR1NFE2L2NPC1
SCHEMBL2556798 0.84 HSD17B10 (0.53) SRCHSD17B10NPSR1NFE2L2NPC1
SCHEMBL2552641 0.84 MAPT (0.40) SRCNPC1RAB9ACA2POLB
SCHEMBL20150988 0.83 SRC (0.56) SRCHSD17B10NPSR1NFE2L2NPC1
SCHEMBL2555240 0.83 SRC (0.56) SRCHSD17B10NPSR1NFE2L2NPC1
SCHEMBL15331806 0.83 PTGDR2 (0.57) HSD17B10NPSR1NPC1RAB9APOLB
SCHEMBL2557724 0.83 SRC (0.50) SRCHSD17B10NPSR1NFE2L2NPC1
SCHEMBL2554954 0.83 SRC (0.50) SRCHSD17B10NPSR1NFE2L2NPC1

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